9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile

C233H142N20O2S — CID 158881442

IUPAC9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile
SMILESCC1(C)c2ccccc2-c2c1ccc1c2c2ccccc2n1-c1cccc(-n2c3ccccc3c3cc(C#N)ccc32)c1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccc(-n2c3ccccc3c3cc(C#N)ccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c(ccc32)oc2ccccc24)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c(ccc32)sc2ccccc24)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c5ccccc5n(-c5ccccc5)c4ccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4oc5cccnc5c4ccc32)c1
InChIInChI=1S/C43H26N4.2C40H27N3.C37H21N3O.C37H21N3S.C36H20N4O/c44-27-28-21-22-39-35(25-28)32-15-4-7-18-36(32)46(39)30-13-10-14-31(26-30)47-38-20-9-6-17-34(38)43-41(47)24-23-40-42(43)33-16-5-8-19-37(33)45(40)29-11-2-1-3-12-29;1-40(2)32-15-6-3-13-29(32)38-33(40)19-21-37-39(38)30-14-5-8-17-35(30)43(37)27-11-9-10-26(23-27)42-34-16-7-4-12-28(34)31-22-25(24-41)18-20-36(31)42;1-40(2)33-15-6-3-12-28(33)30-19-21-37-38(39(30)40)31-14-5-8-17-35(31)43(37)27-11-9-10-26(23-27)42-34-16-7-4-13-29(34)32-22-25(24-41)18-20-36(32)42;2*38-22-23-16-17-32-29(20-23)26-10-1-4-13-30(26)39(32)24-8-7-9-25(21-24)40-31-14-5-2-11-27(31)36-33(40)18-19-35-37(36)28-12-3-6-15-34(28)41-35;37-21-22-14-16-31-28(19-22)25-9-1-3-11-29(25)39(31)23-7-5-8-24(20-23)40-30-12-4-2-10-26(30)34-32(40)17-15-27-35-33(41-36(27)34)13-6-18-38-35/h1-26H;2*3-23H,1-2H3;2*1-21H;1-20H
InChIKeyJDBMMFWEKSGLHZ-UHFFFAOYSA-N
MW3285.90 g/mol
LogP59.79
Rot. Bonds13

About 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile

9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile (PubChem CID 158881442) has the molecular formula C233H142N20O2S and a molecular weight of 3285.90 g/mol. Its IUPAC name is 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile.

Molecular Properties

Compound Name9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile
PubChem CID158881442
Molecular FormulaC233H142N20O2S
Molecular Weight3285.90 g/mol
Exact Mass3283.13
IUPAC Name9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile
SMILESCC1(C)c2ccccc2-c2c1ccc1c2c2ccccc2n1-c1cccc(-n2c3ccccc3c3cc(C#N)ccc32)c1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccc(-n2c3ccccc3c3cc(C#N)ccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c(ccc32)oc2ccccc24)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c(ccc32)sc2ccccc24)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c5ccccc5n(-c5ccccc5)c4ccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4oc5cccnc5c4ccc32)c1
InChIInChI=1S/C43H26N4.2C40H27N3.C37H21N3O.C37H21N3S.C36H20N4O/c44-27-28-21-22-39-35(25-28)32-15-4-7-18-36(32)46(39)30-13-10-14-31(26-30)47-38-20-9-6-17-34(38)43-41(47)24-23-40-42(43)33-16-5-8-19-37(33)45(40)29-11-2-1-3-12-29;1-40(2)32-15-6-3-13-29(32)38-33(40)19-21-37-39(38)30-14-5-8-17-35(30)43(37)27-11-9-10-26(23-27)42-34-16-7-4-12-28(34)31-22-25(24-41)18-20-36(31)42;1-40(2)33-15-6-3-12-28(33)30-19-21-37-38(39(30)40)31-14-5-8-17-35(31)43(37)27-11-9-10-26(23-27)42-34-16-7-4-13-29(34)32-22-25(24-41)18-20-36(32)42;2*38-22-23-16-17-32-29(20-23)26-10-1-4-13-30(26)39(32)24-8-7-9-25(21-24)40-31-14-5-2-11-27(31)36-33(40)18-19-35-37(36)28-12-3-6-15-34(28)41-35;37-21-22-14-16-31-28(19-22)25-9-1-3-11-29(25)39(31)23-7-5-8-24(20-23)40-30-12-4-2-10-26(30)34-32(40)17-15-27-35-33(41-36(27)34)13-6-18-38-35/h1-26H;2*3-23H,1-2H3;2*1-21H;1-20H
InChIKeyJDBMMFWEKSGLHZ-UHFFFAOYSA-N
XLogP59.79
TPSA246.00 Ų
H-Bond Donors
H-Bond Acceptors23
Rotatable Bonds13
Heavy Atoms256
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003285.90
LogP ≤ 559.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1023

Analyze 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile with MolForge

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Related Compounds

9-[3-cyano-5-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[8-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)dibenzoselenophen-2-yl]carbazole-3-carbonitrile;9-[8-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)dibenzoselenophen-2-yl]carbazole-3-carbonitrile;9-[8-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)dibenzoselenophen-2-yl]carbazole-3-carbonitrile;9-[8-(20-thia-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)dibenzoselenophen-2-yl]carbazole-3-carbonitrile
CID 161021292
9-[3-(9-isocyano-[1]benzofuro[3,2-a]carbazol-12-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-isocyano-[1]benzothiolo[3,2-a]carbazol-12-yl)phenyl]carbazole-3-carbonitrile;9-[3-(3-isocyano-7,7-dimethylindeno[1,2-a]carbazol-12-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-isocyano-5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]carbazole-3-carbonitrile
CID 159822931
[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;diphenyl-(9-phenylcarbazol-4-yl)-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]silane;diphenyl-(9-phenylcarbazol-4-yl)-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]silane;[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane
CID 157073661
9-[8-([1]benzofuro[2,3-a]carbazol-12-yl)dibenzothiophen-2-yl]-6-isocyanocarbazole-3-carbonitrile;9-[8-([1]benzothiolo[3,2-a]carbazol-12-yl)dibenzothiophen-2-yl]-6-isocyanocarbazole-3-carbonitrile;9-[7-(7,7-dimethylindeno[1,2-a]carbazol-12-yl)dibenzothiophen-2-yl]carbazole-3-carbonitrile;9-[7-(5-phenylindolo[3,2-c]carbazol-12-yl)dibenzothiophen-2-yl]carbazole-3-carbonitrile
CID 162123031
9-[8-([1]benzofuro[3,2-c]carbazol-5-yl)dibenzothiophen-2-yl]-6-isocyanocarbazole-3-carbonitrile;9-[8-([1]benzothiolo[3,2-c]carbazol-5-yl)dibenzothiophen-2-yl]carbazole-3,6-dicarbonitrile;9-[8-(7,7-dimethylindeno[2,1-b]carbazol-5-yl)dibenzofuran-2-yl]carbazole-3,6-dicarbonitrile;9-[8-(7-phenylindolo[2,3-b]carbazol-5-yl)dibenzofuran-2-yl]carbazole-3,6-dicarbonitrile
CID 158260118
4-[4-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-2-phenyl-[1]benzothiolo[2,3-d]pyrimidine;14-[3-(2-phenyl-[1]benzothiolo[2,3-d]pyrimidin-4-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[3-(2-phenyl-[1]benzothiolo[2,3-d]pyrimidin-4-yl)phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 162102241
9-[3-([1]benzofuro[3,2-b]carbazol-11-yl)phenyl]carbazole-3,6-dicarbonitrile;9-[3-([1]benzothiolo[3,2-b]carbazol-11-yl)phenyl]carbazole-3,6-dicarbonitrile;9-[3-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]carbazole-3,6-dicarbonitrile;9-[3-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]carbazole-3,6-dicarbonitrile
CID 161369579
2-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]-4-phenyl-[1]benzothiolo[2,3-d]pyrimidine;14-[2-(4-phenyl-[1]benzothiolo[2,3-d]pyrimidin-2-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[2-(4-phenyl-[1]benzothiolo[2,3-d]pyrimidin-2-yl)phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 159394132
9-dibenzothiophen-2-yl-14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;12-dibenzothiophen-2-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzothiophen-2-yl-12,12-dimethylindeno[1,2-c]carbazole
CID 157181487
[4-([1]benzofuro[2,3-a]carbazol-12-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;[4-([1]benzofuro[3,2-a]carbazol-12-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;[4-([1]benzothiolo[2,3-a]carbazol-12-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;[4-([1]benzothiolo[3,2-a]carbazol-12-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;[4-(7,7-dimethylindeno[1,2-a]carbazol-12-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;[4-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)phenyl]-diphenyl-(9-phenylcarbazol-4-yl)silane;diphenyl-(9-phenylcarbazol-4-yl)-[4-(11-phenylindolo[2,3-a]carbazol-12-yl)phenyl]silane;diphenyl-(9-phenylcarbazol-4-yl)-[4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]silane
CID 159868158
9-[2-(9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidin-2-yl)phenyl]-14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[2-(9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidin-2-yl)phenyl]-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[2-(9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidin-2-yl)phenyl]-14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;14-[2-(9,9-dimethyl-4-phenylindeno[2,1-d]pyrimidin-2-yl)phenyl]-9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 158882195
5-dibenzofuran-4-yl-10,10-dimethylindeno[1,2-b]indole;5-dibenzofuran-4-yl-12,12-dimethylindeno[1,2-c]carbazole;9-dibenzothiophen-4-yl-14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;12-dibenzothiophen-3-yl-7,7-dimethylindeno[1,2-a]carbazole;5-dibenzothiophen-3-yl-7,7-dimethylindeno[2,1-b]carbazole;5-dibenzothiophen-4-yl-10,10-dimethylindeno[1,2-b]indole;5-dibenzothiophen-4-yl-12,12-dimethylindeno[1,2-c]carbazole;7,7-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[2,1-b]carbazole
CID 159748150

Frequently Asked Questions

What is the IUPAC name of 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile?
The IUPAC name of 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile (CID 158881442) is 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile.
What is the SMILES notation for 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile?
The canonical SMILES for 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile is CC1(C)c2ccccc2-c2c1ccc1c2c2ccccc2n1-c1cccc(-n2c3ccccc3c3cc(C#N)ccc32)c1.CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccc(-n2c3ccccc3c3cc(C#N)ccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c(ccc32)oc2ccccc24)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c(ccc32)sc2ccccc24)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4c5ccccc5n(-c5ccccc5)c4ccc32)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1cccc(-n2c3ccccc3c3c4oc5cccnc5c4ccc32)c1.
What is the InChIKey of 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile?
The InChIKey is JDBMMFWEKSGLHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H26N4.2C40H27N3.C37H21N3O.C37H21N3S.C36H20N4O/c44-27-28-21-22-39-35(25-28)32-15-4-7-18-36(32)46(39)30-13-10-14-31(26-30)47-38-20-9-6-17-34(38)43-41(47)24-23-40-42(43)33-16-5-8-19-37(33)45(40)29-11-2-1-3-12-29;1-40(2)32-15-6-3-13-29(32)38-33(40)19-21-37-39(38)30-14-5-8-17-35(30)43(37)27-11-9-10-26(23-27)42-34-16-7-4-12-28(34)31-22-25(24-41)18-20-36(31)42;1-40(2)33-15-6-3-12-28(33)30-19-21-37-38(39(30)40)31-14-5-8-17-35(31)43(37)27-11-9-10-26(23-27)42-34-16-7-4-13-29(34)32-22-25(24-41)18-20-36(32)42;2*38-22-23-16-17-32-29(20-23)26-10-1-4-13-30(26)39(32)24-8-7-9-25(21-24)40-31-14-5-2-11-27(31)36-33(40)18-19-35-37(36)28-12-3-6-15-34(28)41-35;37-21-22-14-16-31-28(19-22)25-9-1-3-11-29(25)39(31)23-7-5-8-24(20-23)40-30-12-4-2-10-26(30)34-32(40)17-15-27-35-33(41-36(27)34)13-6-18-38-35/h1-26H;2*3-23H,1-2H3;2*1-21H;1-20H.
What are the key properties of 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile?
9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile has a molecular weight of 3285.90 g/mol, XLogP of 59.79, 13 rotatable bonds, 0 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(14,14-dimethyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile;9-[3-(20-oxa-9,15-diazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),2(10),3,5,7,11,14(19),15,17-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(14-phenyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-9-yl)phenyl]carbazole-3-carbonitrile;9-[3-(9-thia-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-14-yl)phenyl]carbazole-3-carbonitrile is sourced from PubChem (CID 158881442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).