11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane

C460H289N23O5S5Si — CID 164955317

IUPAC11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane
SMILESCC1(C)c2cc(-c3ccc4c5ccccc5n5c4c3Oc3ccccc3-5)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2ccccc2N(c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Oc3ccccc3-5)cc2)c2ccccc21.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Sc3ccccc3-5)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6c7ccccc7n7c6c5Sc5ccccc5-7)cc4)ccc32)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Sc3ccccc3-5)cc2)cc1.c1ccc2c(c1)Oc1c(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1c(-c3ccc4c(ccc5cc(-n6c7ccccc7c7ccccc76)ccc54)c3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1c(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Sc1c(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Sc1c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc3c4ccccc4n-2c13
InChIInChI=1S/C54H33N3S.C54H36N2SSi.C51H35N3O.C48H29N3S.C48H30N2S.C45H30N2O.C44H26N2O.2C40H24N2O.C36H22N2S/c1-2-12-37(13-3-1)55-46-17-7-5-15-41(46)44-32-35(24-30-49(44)55)36-25-31-50-45(33-36)42-16-6-8-18-47(42)56(50)38-26-22-34(23-27-38)39-28-29-43-40-14-4-9-19-48(40)57-51-20-10-11-21-52(51)58-54(39)53(43)57;1-4-16-39(17-5-1)58(40-18-6-2-7-19-40,41-20-8-3-9-21-41)42-32-35-50-47(36-42)45-23-11-12-24-48(45)55(50)38-30-28-37(29-31-38)43-33-34-46-44-22-10-13-25-49(44)56-51-26-14-15-27-52(51)57-54(43)53(46)56;1-51(2)40-15-5-9-19-45(40)53(46-20-10-6-16-41(46)51)34-27-30-44-39(31-34)37-14-4-7-17-42(37)52(44)33-25-23-32(24-26-33)35-28-29-38-36-13-3-8-18-43(36)54-47-21-11-12-22-48(47)55-50(35)49(38)54;1-5-15-40-34(11-1)35-12-2-6-16-41(35)50(40)32-25-28-44-39(29-32)37-14-4-7-17-42(37)49(44)31-23-21-30(22-24-31)33-26-27-38-36-13-3-8-18-43(36)51-45-19-9-10-20-46(45)52-48(33)47(38)51;1-3-11-31(12-4-1)34-21-27-43-40(29-34)41-30-35(32-13-5-2-6-14-32)22-28-44(41)49(43)36-23-19-33(20-24-36)37-25-26-39-38-15-7-8-16-42(38)50-45-17-9-10-18-46(45)51-48(37)47(39)50;1-45(2)36-25-27(29-23-24-35-34-13-5-8-16-40(34)47-41-17-9-10-18-42(41)48-44(29)43(35)47)19-21-30(36)31-22-20-28(26-37(31)45)46-38-14-6-3-11-32(38)33-12-4-7-15-39(33)46;1-4-12-38-34(9-1)35-10-2-5-13-39(35)45(38)30-20-22-32-29(26-30)18-17-27-25-28(19-21-31(27)32)33-23-24-37-36-11-3-6-14-40(36)46-41-15-7-8-16-42(41)47-44(33)43(37)46;1-4-12-34-30(9-1)31-10-2-5-13-35(31)41(34)28-20-19-25-23-27(18-17-26(25)24-28)29-21-22-33-32-11-3-6-14-36(32)42-37-15-7-8-16-38(37)43-40(29)39(33)42;1-2-12-27-25(11-1)26(23-24-36(27)41-33-16-6-3-13-28(33)29-14-4-7-17-34(29)41)32-22-21-31-30-15-5-8-18-35(30)42-37-19-9-10-20-38(37)43-40(32)39(31)42;1-4-12-30-26(9-1)27-10-2-5-13-31(27)37(30)24-19-17-23(18-20-24)25-21-22-29-28-11-3-6-14-32(28)38-33-15-7-8-16-34(33)39-36(25)35(29)38/h1-33H;1-36H;3-31H,1-2H3;1-29H;1-30H;3-26H,1-2H3;1-26H;2*1-24H;1-22H
InChIKeyBCAXFNQJANPPAA-UHFFFAOYSA-N
MW6406.95 g/mol
LogP121.93
Rot. Bonds30

About 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane

11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane (PubChem CID 164955317) has the molecular formula C460H289N23O5S5Si and a molecular weight of 6406.95 g/mol. Its IUPAC name is 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane.

Molecular Properties

Compound Name11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane
PubChem CID164955317
Molecular FormulaC460H289N23O5S5Si
Molecular Weight6406.95 g/mol
Exact Mass6401.14
IUPAC Name11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane
SMILESCC1(C)c2cc(-c3ccc4c5ccccc5n5c4c3Oc3ccccc3-5)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2ccccc2N(c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Oc3ccccc3-5)cc2)c2ccccc21.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Sc3ccccc3-5)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6c7ccccc7n7c6c5Sc5ccccc5-7)cc4)ccc32)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Sc3ccccc3-5)cc2)cc1.c1ccc2c(c1)Oc1c(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1c(-c3ccc4c(ccc5cc(-n6c7ccccc7c7ccccc76)ccc54)c3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1c(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Sc1c(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Sc1c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc3c4ccccc4n-2c13
InChIInChI=1S/C54H33N3S.C54H36N2SSi.C51H35N3O.C48H29N3S.C48H30N2S.C45H30N2O.C44H26N2O.2C40H24N2O.C36H22N2S/c1-2-12-37(13-3-1)55-46-17-7-5-15-41(46)44-32-35(24-30-49(44)55)36-25-31-50-45(33-36)42-16-6-8-18-47(42)56(50)38-26-22-34(23-27-38)39-28-29-43-40-14-4-9-19-48(40)57-51-20-10-11-21-52(51)58-54(39)53(43)57;1-4-16-39(17-5-1)58(40-18-6-2-7-19-40,41-20-8-3-9-21-41)42-32-35-50-47(36-42)45-23-11-12-24-48(45)55(50)38-30-28-37(29-31-38)43-33-34-46-44-22-10-13-25-49(44)56-51-26-14-15-27-52(51)57-54(43)53(46)56;1-51(2)40-15-5-9-19-45(40)53(46-20-10-6-16-41(46)51)34-27-30-44-39(31-34)37-14-4-7-17-42(37)52(44)33-25-23-32(24-26-33)35-28-29-38-36-13-3-8-18-43(36)54-47-21-11-12-22-48(47)55-50(35)49(38)54;1-5-15-40-34(11-1)35-12-2-6-16-41(35)50(40)32-25-28-44-39(29-32)37-14-4-7-17-42(37)49(44)31-23-21-30(22-24-31)33-26-27-38-36-13-3-8-18-43(36)51-45-19-9-10-20-46(45)52-48(33)47(38)51;1-3-11-31(12-4-1)34-21-27-43-40(29-34)41-30-35(32-13-5-2-6-14-32)22-28-44(41)49(43)36-23-19-33(20-24-36)37-25-26-39-38-15-7-8-16-42(38)50-45-17-9-10-18-46(45)51-48(37)47(39)50;1-45(2)36-25-27(29-23-24-35-34-13-5-8-16-40(34)47-41-17-9-10-18-42(41)48-44(29)43(35)47)19-21-30(36)31-22-20-28(26-37(31)45)46-38-14-6-3-11-32(38)33-12-4-7-15-39(33)46;1-4-12-38-34(9-1)35-10-2-5-13-39(35)45(38)30-20-22-32-29(26-30)18-17-27-25-28(19-21-31(27)32)33-23-24-37-36-11-3-6-14-40(36)46-41-15-7-8-16-42(41)47-44(33)43(37)46;1-4-12-34-30(9-1)31-10-2-5-13-35(31)41(34)28-20-19-25-23-27(18-17-26(25)24-28)29-21-22-33-32-11-3-6-14-36(32)42-37-15-7-8-16-38(37)43-40(29)39(33)42;1-2-12-27-25(11-1)26(23-24-36(27)41-33-16-6-3-13-28(33)29-14-4-7-17-34(29)41)32-22-21-31-30-15-5-8-18-35(30)42-37-19-9-10-20-38(37)43-40(32)39(31)42;1-4-12-30-26(9-1)27-10-2-5-13-31(27)37(30)24-19-17-23(18-20-24)25-21-22-29-28-11-3-6-14-32(28)38-33-15-7-8-16-34(33)39-36(25)35(29)38/h1-33H;1-36H;3-31H,1-2H3;1-29H;1-30H;3-26H,1-2H3;1-26H;2*1-24H;1-22H
InChIKeyBCAXFNQJANPPAA-UHFFFAOYSA-N
XLogP121.93
TPSA157.85 Ų
H-Bond Donors
H-Bond Acceptors33
Rotatable Bonds30
Heavy Atoms494
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006406.95
LogP ≤ 5121.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1033

Analyze 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane with MolForge

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Related Compounds

3-[9-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[7-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-phenanthren-2-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 159107131
3-[9-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]carbazol-3-yl]-9-phenylcarbazole;3-[9-(6-phenanthren-2-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole;3-[9-(7-phenanthren-2-ylnaphthalen-2-yl)carbazol-3-yl]-9-phenylcarbazole
CID 158579242
10-[3-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-[4-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-(3-carbazol-9-ylphenyl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-[4-(4-carbazol-9-ylphenyl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-[4-[4-(3,6-diphenylcarbazol-9-yl)phenyl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;10-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-10-yl)phenyl]carbazol-3-yl]silane
CID 164964628
9,9-dimethyl-10-phenyl-2-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]acridine;10-phenyl-3-[9-phenyl-6-(9-phenylcarbazol-3-yl)carbazol-3-yl]phenoxazine;10-phenyl-3-[9-phenyl-6-(10-phenylphenothiazin-3-yl)carbazol-3-yl]phenoxazine
CID 161400773
6-(9,9-dimethylfluoren-2-yl)-2-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)-6-triphenylen-2-ylcarbazole;6-phenanthren-9-yl-2-(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole
CID 161421085
3-(4-carbazol-9-ylnaphthalen-1-yl)-6-phenyl-[1]benzofuro[2,3-b]indole;3-(4-carbazol-9-ylphenyl)-6-(3,5-diphenylphenyl)-[1]benzofuro[2,3-b]indole;3-(4-carbazol-9-ylphenyl)-6-phenanthren-9-yl-[1]benzofuro[2,3-b]indole;3-[4-(3,6-difluorocarbazol-9-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole;3-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole;3-[4-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole;3-[4-(3-phenoxazin-10-ylcarbazol-9-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole;triphenyl-[9-[4-(6-phenyl-[1]benzofuro[2,3-b]indol-3-yl)phenyl]carbazol-3-yl]silane
CID 167707885
3-(3,5-diphenylphenyl)-9-(4-phenylphenyl)carbazole;(9-naphthalen-2-ylcarbazol-3-yl)-triphenylsilane;9-phenyl-3-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]carbazole
CID 158565802
11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylnaphthalen-1-yl)indeno[1,2-b]carbazole;bis(11,11-dimethyl-5-(5-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole);11,11-dimethyl-5-(7-phenylnaphthalen-2-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(3-phenylphenyl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole
CID 157178540
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-(9-naphthalen-2-ylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;3-[9-(4-phenylphenyl)carbazol-3-yl]-9-triphenylen-2-ylcarbazole
CID 159796041
2-(7,10-diphenylspiro[acridine-9,9'-thioxanthene]-2-yl)-7,10-diphenylspiro[acridine-9,9'-xanthene];10-(9-phenylcarbazol-2-yl)-2-(9-phenylcarbazol-3-yl)spiro[acridine-9,9'-thioxanthene];10'-(4-phenylphenyl)spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-acridine];10'-(4-phenylphenyl)spiro[2-oxapentacyclo[12.8.0.03,12.05,10.016,21]docosa-1(22),3,5,7,9,11,14,16,18,20-decaene-13,9'-acridine];12,12,20,20-tetramethyl-16-(4-phenylphenyl)spiro[16-azaheptacyclo[15.11.0.03,15.05,13.06,11.019,27.021,26]octacosa-1(17),3(15),4,6,8,10,13,18,21,23,25,27-dodecaene-2,9'-thioxanthene];2,7,10-triphenylspiro[acridine-9,9'-thioxanthene]
CID 157437189
[9-[6-(2,5-diphenylphenyl)-9-phenylcarbazol-3-yl]carbazol-3-yl]-triphenylsilane
CID 174149154
4-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-6-phenyl-[1]benzothiolo[2,3-b]indole;4-(4-carbazol-9-yl-5,6-dihydronaphthalen-1-yl)-6-phenyl-[1]benzofuro[2,3-b]indole;4-(6-carbazol-9-ylnaphthalen-2-yl)-6-phenyl-[1]benzofuro[2,3-b]indole;4-(7-carbazol-9-ylphenanthren-2-yl)-6-phenyl-[1]benzofuro[2,3-b]indole;4-(4-carbazol-9-ylphenyl)-6-phenyl-[1]benzothiolo[2,3-b]indole;4-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole;4-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-6-phenyl-[1]benzothiolo[2,3-b]indole;4-[4-(3-phenoxazin-10-ylcarbazol-9-yl)phenyl]-6-phenyl-[1]benzofuro[2,3-b]indole
CID 167552235

Frequently Asked Questions

What is the IUPAC name of 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane?
The IUPAC name of 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane (CID 164955317) is 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane.
What is the SMILES notation for 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane?
The canonical SMILES for 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane is CC1(C)c2cc(-c3ccc4c5ccccc5n5c4c3Oc3ccccc3-5)ccc2-c2ccc(-n3c4ccccc4c4ccccc43)cc21.CC1(C)c2ccccc2N(c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Oc3ccccc3-5)cc2)c2ccccc21.c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Sc3ccccc3-5)cc2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccc6c7ccccc7n7c6c5Sc5ccccc5-7)cc4)ccc32)cc1.c1ccc([Si](c2ccccc2)(c2ccccc2)c2ccc3c(c2)c2ccccc2n3-c2ccc(-c3ccc4c5ccccc5n5c4c3Sc3ccccc3-5)cc2)cc1.c1ccc2c(c1)Oc1c(-c3ccc(-n4c5ccccc5c5ccccc54)c4ccccc34)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1c(-c3ccc4c(ccc5cc(-n6c7ccccc7c7ccccc76)ccc54)c3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Oc1c(-c3ccc4cc(-n5c6ccccc6c6ccccc65)ccc4c3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Sc1c(-c3ccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)cc3)ccc3c4ccccc4n-2c13.c1ccc2c(c1)Sc1c(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)ccc3c4ccccc4n-2c13.
What is the InChIKey of 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane?
The InChIKey is BCAXFNQJANPPAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C54H33N3S.C54H36N2SSi.C51H35N3O.C48H29N3S.C48H30N2S.C45H30N2O.C44H26N2O.2C40H24N2O.C36H22N2S/c1-2-12-37(13-3-1)55-46-17-7-5-15-41(46)44-32-35(24-30-49(44)55)36-25-31-50-45(33-36)42-16-6-8-18-47(42)56(50)38-26-22-34(23-27-38)39-28-29-43-40-14-4-9-19-48(40)57-51-20-10-11-21-52(51)58-54(39)53(43)57;1-4-16-39(17-5-1)58(40-18-6-2-7-19-40,41-20-8-3-9-21-41)42-32-35-50-47(36-42)45-23-11-12-24-48(45)55(50)38-30-28-37(29-31-38)43-33-34-46-44-22-10-13-25-49(44)56-51-26-14-15-27-52(51)57-54(43)53(46)56;1-51(2)40-15-5-9-19-45(40)53(46-20-10-6-16-41(46)51)34-27-30-44-39(31-34)37-14-4-7-17-42(37)52(44)33-25-23-32(24-26-33)35-28-29-38-36-13-3-8-18-43(36)54-47-21-11-12-22-48(47)55-50(35)49(38)54;1-5-15-40-34(11-1)35-12-2-6-16-41(35)50(40)32-25-28-44-39(29-32)37-14-4-7-17-42(37)49(44)31-23-21-30(22-24-31)33-26-27-38-36-13-3-8-18-43(36)51-45-19-9-10-20-46(45)52-48(33)47(38)51;1-3-11-31(12-4-1)34-21-27-43-40(29-34)41-30-35(32-13-5-2-6-14-32)22-28-44(41)49(43)36-23-19-33(20-24-36)37-25-26-39-38-15-7-8-16-42(38)50-45-17-9-10-18-46(45)51-48(37)47(39)50;1-45(2)36-25-27(29-23-24-35-34-13-5-8-16-40(34)47-41-17-9-10-18-42(41)48-44(29)43(35)47)19-21-30(36)31-22-20-28(26-37(31)45)46-38-14-6-3-11-32(38)33-12-4-7-15-39(33)46;1-4-12-38-34(9-1)35-10-2-5-13-39(35)45(38)30-20-22-32-29(26-30)18-17-27-25-28(19-21-31(27)32)33-23-24-37-36-11-3-6-14-40(36)46-41-15-7-8-16-42(41)47-44(33)43(37)46;1-4-12-34-30(9-1)31-10-2-5-13-35(31)41(34)28-20-19-25-23-27(18-17-26(25)24-28)29-21-22-33-32-11-3-6-14-36(32)42-37-15-7-8-16-38(37)43-40(29)39(33)42;1-2-12-27-25(11-1)26(23-24-36(27)41-33-16-6-3-13-28(33)29-14-4-7-17-34(29)41)32-22-21-31-30-15-5-8-18-35(30)42-37-19-9-10-20-38(37)43-40(32)39(31)42;1-4-12-30-26(9-1)27-10-2-5-13-31(27)37(30)24-19-17-23(18-20-24)25-21-22-29-28-11-3-6-14-32(28)38-33-15-7-8-16-34(33)39-36(25)35(29)38/h1-33H;1-36H;3-31H,1-2H3;1-29H;1-30H;3-26H,1-2H3;1-26H;2*1-24H;1-22H.
What are the key properties of 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane?
11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane has a molecular weight of 6406.95 g/mol, XLogP of 121.93, 30 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-yl-9,9-dimethylfluoren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylnaphthalen-1-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(6-carbazol-9-ylnaphthalen-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(7-carbazol-9-ylphenanthren-2-yl)-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-(4-carbazol-9-ylphenyl)-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9,9-dimethylacridin-10-yl)carbazol-9-yl]phenyl]-13-oxa-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-(3,6-diphenylcarbazol-9-yl)phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;11-[4-[3-(9-phenylcarbazol-3-yl)carbazol-9-yl]phenyl]-13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene;triphenyl-[9-[4-(13-thia-1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaen-11-yl)phenyl]carbazol-3-yl]silane is sourced from PubChem (CID 164955317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).