9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole

C391H229N15O17 — CID 159793661

IUPAC9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole
SMILESc1ccc(-c2cc(-c3ccc4oc5c(ccc6c7cc(-n8c9ccccc9c9ccccc98)ccc7oc65)c4c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc3c4cc(-n5c6ccccc6c6ccccc65)ccc4oc3c3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c23)cc1.c1ccc(-c2ccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)cc2)cc1.c1ccc(-c2ccc3oc4ccc(-c5ccc6oc7c(ccc8c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc9oc87)c6c5)cc4c3c2)cc1.c1ccc(-c2cccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)c2)cc1.c1ccc(Cc2ccc3oc4c(ccc5c6cc(-n7c8ccccc8c8ccccc87)ccc6oc54)c3c2)cc1.c1ccc2c(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)cccc2c1.c1ccc2cc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)ccc2c1
InChIInChI=1S/2C54H32N2O2.2C52H30N2O2.C48H28N2O2.C48H27NO3.C46H27N3O2.C37H23NO2/c1-2-13-33(14-3-1)34-15-12-16-35(29-34)42-32-44-43-30-36(55-46-21-8-4-17-38(46)39-18-5-9-22-47(39)55)25-27-50(43)57-53(44)54-52(42)45-31-37(26-28-51(45)58-54)56-48-23-10-6-19-40(48)41-20-7-11-24-49(41)56;1-2-12-33(13-3-1)34-22-24-35(25-23-34)42-32-44-43-30-36(55-46-18-8-4-14-38(46)39-15-5-9-19-47(39)55)26-28-50(43)57-53(44)54-52(42)45-31-37(27-29-51(45)58-54)56-48-20-10-6-16-40(48)41-17-7-11-21-49(41)56;1-2-14-34-31(12-1)13-11-19-35(34)41-30-42-40-28-32(53-44-20-7-3-15-36(44)37-16-4-8-21-45(37)53)24-26-48(40)55-51(42)52-50(41)43-29-33(25-27-49(43)56-52)54-46-22-9-5-17-38(46)39-18-6-10-23-47(39)54;1-2-12-32-27-33(22-21-31(32)11-1)40-30-42-41-28-34(53-44-17-7-3-13-36(44)37-14-4-8-18-45(37)53)23-25-48(41)55-51(42)52-50(40)43-29-35(24-26-49(43)56-52)54-46-19-9-5-15-38(46)39-16-6-10-20-47(39)54;1-2-12-29(13-3-1)36-28-38-37-26-30(49-40-18-8-4-14-32(40)33-15-5-9-19-41(33)49)22-24-44(37)51-47(38)48-46(36)39-27-31(23-25-45(39)52-48)50-42-20-10-6-16-34(42)35-17-7-11-21-43(35)50;1-2-8-28(9-3-1)29-14-20-43-38(24-29)39-26-31(15-21-44(39)50-43)30-16-22-45-37(25-30)35-18-19-36-40-27-32(17-23-46(40)52-48(36)47(35)51-45)49-41-12-6-4-10-33(41)34-11-5-7-13-42(34)49;1-3-11-28(12-4-1)38-27-39(48-46(47-38)29-13-5-2-6-14-29)30-19-23-42-36(25-30)34-21-22-35-37-26-31(20-24-43(37)51-45(35)44(34)50-42)49-40-17-9-7-15-32(40)33-16-8-10-18-41(33)49;1-2-8-23(9-3-1)20-24-14-18-34-30(21-24)28-16-17-29-31-22-25(15-19-35(31)40-37(29)36(28)39-34)38-32-12-6-4-10-26(32)27-11-5-7-13-33(27)38/h2*1-32H;2*1-30H;1-28H;1-27H;1-27H;1-19,21-22H,20H2
InChIKeyNIWUOVBMDQSXLJ-UHFFFAOYSA-N
MW5409.22 g/mol
LogP108.74
Rot. Bonds27

About 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole

9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole (PubChem CID 159793661) has the molecular formula C391H229N15O17 and a molecular weight of 5409.22 g/mol. Its IUPAC name is 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole.

Molecular Properties

Compound Name9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole
PubChem CID159793661
Molecular FormulaC391H229N15O17
Molecular Weight5409.22 g/mol
Exact Mass5404.75
IUPAC Name9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole
SMILESc1ccc(-c2cc(-c3ccc4oc5c(ccc6c7cc(-n8c9ccccc9c9ccccc98)ccc7oc65)c4c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc3c4cc(-n5c6ccccc6c6ccccc65)ccc4oc3c3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c23)cc1.c1ccc(-c2ccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)cc2)cc1.c1ccc(-c2ccc3oc4ccc(-c5ccc6oc7c(ccc8c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc9oc87)c6c5)cc4c3c2)cc1.c1ccc(-c2cccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)c2)cc1.c1ccc(Cc2ccc3oc4c(ccc5c6cc(-n7c8ccccc8c8ccccc87)ccc6oc54)c3c2)cc1.c1ccc2c(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)cccc2c1.c1ccc2cc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)ccc2c1
InChIInChI=1S/2C54H32N2O2.2C52H30N2O2.C48H28N2O2.C48H27NO3.C46H27N3O2.C37H23NO2/c1-2-13-33(14-3-1)34-15-12-16-35(29-34)42-32-44-43-30-36(55-46-21-8-4-17-38(46)39-18-5-9-22-47(39)55)25-27-50(43)57-53(44)54-52(42)45-31-37(26-28-51(45)58-54)56-48-23-10-6-19-40(48)41-20-7-11-24-49(41)56;1-2-12-33(13-3-1)34-22-24-35(25-23-34)42-32-44-43-30-36(55-46-18-8-4-14-38(46)39-15-5-9-19-47(39)55)26-28-50(43)57-53(44)54-52(42)45-31-37(27-29-51(45)58-54)56-48-20-10-6-16-40(48)41-17-7-11-21-49(41)56;1-2-14-34-31(12-1)13-11-19-35(34)41-30-42-40-28-32(53-44-20-7-3-15-36(44)37-16-4-8-21-45(37)53)24-26-48(40)55-51(42)52-50(41)43-29-33(25-27-49(43)56-52)54-46-22-9-5-17-38(46)39-18-6-10-23-47(39)54;1-2-12-32-27-33(22-21-31(32)11-1)40-30-42-41-28-34(53-44-17-7-3-13-36(44)37-14-4-8-18-45(37)53)23-25-48(41)55-51(42)52-50(40)43-29-35(24-26-49(43)56-52)54-46-19-9-5-15-38(46)39-16-6-10-20-47(39)54;1-2-12-29(13-3-1)36-28-38-37-26-30(49-40-18-8-4-14-32(40)33-15-5-9-19-41(33)49)22-24-44(37)51-47(38)48-46(36)39-27-31(23-25-45(39)52-48)50-42-20-10-6-16-34(42)35-17-7-11-21-43(35)50;1-2-8-28(9-3-1)29-14-20-43-38(24-29)39-26-31(15-21-44(39)50-43)30-16-22-45-37(25-30)35-18-19-36-40-27-32(17-23-46(40)52-48(36)47(35)51-45)49-41-12-6-4-10-33(41)34-11-5-7-13-42(34)49;1-3-11-28(12-4-1)38-27-39(48-46(47-38)29-13-5-2-6-14-29)30-19-23-42-36(25-30)34-21-22-35-37-26-31(20-24-43(37)51-45(35)44(34)50-42)49-40-17-9-7-15-32(40)33-16-8-10-18-41(33)49;1-2-8-23(9-3-1)20-24-14-18-34-30(21-24)28-16-17-29-31-22-25(15-19-35(31)40-37(29)36(28)39-34)38-32-12-6-4-10-26(32)27-11-5-7-13-33(27)38/h2*1-32H;2*1-30H;1-28H;1-27H;1-27H;1-19,21-22H,20H2
InChIKeyNIWUOVBMDQSXLJ-UHFFFAOYSA-N
XLogP108.74
TPSA313.25 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds27
Heavy Atoms423
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005409.22
LogP ≤ 5108.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole?
The IUPAC name of 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole (CID 159793661) is 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole.
What is the SMILES notation for 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole?
The canonical SMILES for 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole is c1ccc(-c2cc(-c3ccc4oc5c(ccc6c7cc(-n8c9ccccc9c9ccccc98)ccc7oc65)c4c3)nc(-c3ccccc3)n2)cc1.c1ccc(-c2cc3c4cc(-n5c6ccccc6c6ccccc65)ccc4oc3c3oc4ccc(-n5c6ccccc6c6ccccc65)cc4c23)cc1.c1ccc(-c2ccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)cc2)cc1.c1ccc(-c2ccc3oc4ccc(-c5ccc6oc7c(ccc8c9cc(-n%10c%11ccccc%11c%11ccccc%11%10)ccc9oc87)c6c5)cc4c3c2)cc1.c1ccc(-c2cccc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)c2)cc1.c1ccc(Cc2ccc3oc4c(ccc5c6cc(-n7c8ccccc8c8ccccc87)ccc6oc54)c3c2)cc1.c1ccc2c(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)cccc2c1.c1ccc2cc(-c3cc4c5cc(-n6c7ccccc7c7ccccc76)ccc5oc4c4oc5ccc(-n6c7ccccc7c7ccccc76)cc5c34)ccc2c1.
What is the InChIKey of 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole?
The InChIKey is NIWUOVBMDQSXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H32N2O2.2C52H30N2O2.C48H28N2O2.C48H27NO3.C46H27N3O2.C37H23NO2/c1-2-13-33(14-3-1)34-15-12-16-35(29-34)42-32-44-43-30-36(55-46-21-8-4-17-38(46)39-18-5-9-22-47(39)55)25-27-50(43)57-53(44)54-52(42)45-31-37(26-28-51(45)58-54)56-48-23-10-6-19-40(48)41-20-7-11-24-49(41)56;1-2-12-33(13-3-1)34-22-24-35(25-23-34)42-32-44-43-30-36(55-46-18-8-4-14-38(46)39-15-5-9-19-47(39)55)26-28-50(43)57-53(44)54-52(42)45-31-37(27-29-51(45)58-54)56-48-20-10-6-16-40(48)41-17-7-11-21-49(41)56;1-2-14-34-31(12-1)13-11-19-35(34)41-30-42-40-28-32(53-44-20-7-3-15-36(44)37-16-4-8-21-45(37)53)24-26-48(40)55-51(42)52-50(41)43-29-33(25-27-49(43)56-52)54-46-22-9-5-17-38(46)39-18-6-10-23-47(39)54;1-2-12-32-27-33(22-21-31(32)11-1)40-30-42-41-28-34(53-44-17-7-3-13-36(44)37-14-4-8-18-45(37)53)23-25-48(41)55-51(42)52-50(40)43-29-35(24-26-49(43)56-52)54-46-19-9-5-15-38(46)39-16-6-10-20-47(39)54;1-2-12-29(13-3-1)36-28-38-37-26-30(49-40-18-8-4-14-32(40)33-15-5-9-19-41(33)49)22-24-44(37)51-47(38)48-46(36)39-27-31(23-25-45(39)52-48)50-42-20-10-6-16-34(42)35-17-7-11-21-43(35)50;1-2-8-28(9-3-1)29-14-20-43-38(24-29)39-26-31(15-21-44(39)50-43)30-16-22-45-37(25-30)35-18-19-36-40-27-32(17-23-46(40)52-48(36)47(35)51-45)49-41-12-6-4-10-33(41)34-11-5-7-13-42(34)49;1-3-11-28(12-4-1)38-27-39(48-46(47-38)29-13-5-2-6-14-29)30-19-23-42-36(25-30)34-21-22-35-37-26-31(20-24-43(37)51-45(35)44(34)50-42)49-40-17-9-7-15-32(40)33-16-8-10-18-41(33)49;1-2-8-23(9-3-1)20-24-14-18-34-30(21-24)28-16-17-29-31-22-25(15-19-35(31)40-37(29)36(28)39-34)38-32-12-6-4-10-26(32)27-11-5-7-13-33(27)38/h2*1-32H;2*1-30H;1-28H;1-27H;1-27H;1-19,21-22H,20H2.
What are the key properties of 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole?
9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole has a molecular weight of 5409.22 g/mol, XLogP of 108.74, 27 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(16-benzyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-1-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-naphthalen-2-yl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-(16-carbazol-9-yl-11-phenyl-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl)carbazole;9-[16-carbazol-9-yl-11-(3-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-carbazol-9-yl-11-(4-phenylphenyl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1,4(9),5,7,10,12,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(2,6-diphenylpyrimidin-4-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole;9-[16-(8-phenyldibenzofuran-2-yl)-3,20-dioxapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14(19),15,17-nonaen-7-yl]carbazole is sourced from PubChem (CID 159793661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).