3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole

C266H171N27O3S — CID 158571148

IUPAC3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)o5)c34)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7ccccc7)o6)c5cc43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccc(-c6ccccc6)o5)c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7ccccn7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(N(c7ccccc7)c7ccccc7)c6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccs6)c5c43)n2)cc1
InChIInChI=1S/C52H35N5.C44H28N6.3C44H28N4O.C38H24N4S/c1-5-18-36(19-6-1)46-35-47(37-20-7-2-8-21-37)54-52(53-46)57-49-31-16-14-29-43(49)45-33-32-44-42-28-13-15-30-48(42)56(50(44)51(45)57)41-27-17-26-40(34-41)55(38-22-9-3-10-23-38)39-24-11-4-12-25-39;1-3-14-29(15-4-1)37-28-38(30-16-5-2-6-17-30)48-44(47-37)50-40-23-10-8-19-32(40)34-26-25-33-31-18-7-9-22-39(31)49(42(33)43(34)50)41-24-13-21-36(46-41)35-20-11-12-27-45-35;1-4-14-29(15-5-1)36-27-37(30-16-6-2-7-17-30)46-44(45-36)48-39-23-13-11-21-33(39)35-26-34-32-20-10-12-22-38(32)47(40(34)28-41(35)48)43-25-24-42(49-43)31-18-8-3-9-19-31;1-4-14-29(15-5-1)35-28-36(30-16-6-2-7-17-30)46-44(45-35)47-38-23-13-11-21-34(38)42-39(47)25-24-33-32-20-10-12-22-37(32)48(43(33)42)41-27-26-40(49-41)31-18-8-3-9-19-31;1-4-14-29(15-5-1)35-28-36(30-16-6-2-7-17-30)46-44(45-35)48-37-22-12-10-20-32(37)33-24-25-39-42(43(33)48)34-21-11-13-23-38(34)47(39)41-27-26-40(49-41)31-18-8-3-9-19-31;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)40-38(39-31)42-34-19-10-8-17-28(34)30-22-21-29-27-16-7-9-18-33(27)41(36(29)37(30)42)35-20-11-23-43-35/h1-35H;1-28H;3*1-28H;1-24H
InChIKeyHSCCCQAXTTUFJD-UHFFFAOYSA-N
MW3825.55 g/mol
LogP67.80
Rot. Bonds31

About 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole

3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole (PubChem CID 158571148) has the molecular formula C266H171N27O3S and a molecular weight of 3825.55 g/mol. Its IUPAC name is 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole.

Molecular Properties

Compound Name3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole
PubChem CID158571148
Molecular FormulaC266H171N27O3S
Molecular Weight3825.55 g/mol
Exact Mass3822.38
IUPAC Name3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)o5)c34)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7ccccc7)o6)c5cc43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccc(-c6ccccc6)o5)c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7ccccn7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(N(c7ccccc7)c7ccccc7)c6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccs6)c5c43)n2)cc1
InChIInChI=1S/C52H35N5.C44H28N6.3C44H28N4O.C38H24N4S/c1-5-18-36(19-6-1)46-35-47(37-20-7-2-8-21-37)54-52(53-46)57-49-31-16-14-29-43(49)45-33-32-44-42-28-13-15-30-48(42)56(50(44)51(45)57)41-27-17-26-40(34-41)55(38-22-9-3-10-23-38)39-24-11-4-12-25-39;1-3-14-29(15-4-1)37-28-38(30-16-5-2-6-17-30)48-44(47-37)50-40-23-10-8-19-32(40)34-26-25-33-31-18-7-9-22-39(31)49(42(33)43(34)50)41-24-13-21-36(46-41)35-20-11-12-27-45-35;1-4-14-29(15-5-1)36-27-37(30-16-6-2-7-17-30)46-44(45-36)48-39-23-13-11-21-33(39)35-26-34-32-20-10-12-22-38(32)47(40(34)28-41(35)48)43-25-24-42(49-43)31-18-8-3-9-19-31;1-4-14-29(15-5-1)35-28-36(30-16-6-2-7-17-30)46-44(45-35)47-38-23-13-11-21-34(38)42-39(47)25-24-33-32-20-10-12-22-37(32)48(43(33)42)41-27-26-40(49-41)31-18-8-3-9-19-31;1-4-14-29(15-5-1)35-28-36(30-16-6-2-7-17-30)46-44(45-35)48-37-22-12-10-20-32(37)33-24-25-39-42(43(33)48)34-21-11-13-23-38(34)47(39)41-27-26-40(49-41)31-18-8-3-9-19-31;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)40-38(39-31)42-34-19-10-8-17-28(34)30-22-21-29-27-16-7-9-18-33(27)41(36(29)37(30)42)35-20-11-23-43-35/h1-35H;1-28H;3*1-28H;1-24H
InChIKeyHSCCCQAXTTUFJD-UHFFFAOYSA-N
XLogP67.80
TPSA282.28 Ų
H-Bond Donors
H-Bond Acceptors31
Rotatable Bonds31
Heavy Atoms297
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003825.55
LogP ≤ 567.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1031

Analyze 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole with MolForge

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Related Compounds

bis(N-[3-[[2-(furan-3-yl)-9-methylpurin-6-yl]amino]-4-methylphenyl]-3-(trifluoromethyl)benzamide);N-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(9-methyl-2-pyridin-4-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(9-methyl-2-thiophen-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
CID 157464586
1-[4-[8-amino-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-3-yl]piperidin-1-yl]-2-[4-(trifluoromethoxy)phenyl]ethanone;[4-(8-amino-1-quinolin-7-ylimidazo[1,5-a]pyrazin-3-yl)piperidin-1-yl]-thiophen-3-ylmethanone;3-[4-(1H-benzimidazol-2-yl)cyclohexyl]-1-(1H-indol-2-yl)imidazo[1,5-a]pyrazin-8-amine
CID 159047989
3,6-dimethyl-[1]benzofuro[2,3-b]pyridine;4,12-dimethyl-8-oxa-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5,8-dimethylpyrido[4,3-b]indole;2,6-dimethylquinazoline;4,12-dimethyl-8-thia-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methylbenzene-1,3-dicarbonitrile;9-methyl-N,N-diphenylcarbazol-3-amine;9-methyl-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;3,6,9-trimethylcarbazole
CID 159290113
CID 159485479
CID 159485479
CID 159617407
CID 159617407
3-[4-(Benzimidazol-1-yl)-2-cyclopentyloxypyrimidin-5-yl]benzamide;4-[4-(benzimidazol-1-yl)-2-cyclopentyloxypyrimidin-5-yl]benzamide;3-[4-(benzimidazol-1-yl)-2-(3-methylcyclobutyl)oxypyrimidin-5-yl]benzamide;1-(2-cyclopentyloxy-5-thiophen-3-ylpyrimidin-4-yl)benzimidazole;1-[5-cyclopropyl-2-(3-methylcyclobutyl)oxypyrimidin-4-yl]benzimidazole;1-[2-(3-methylcyclobutyl)oxy-5-[2-(trifluoromethoxy)phenyl]pyrimidin-4-yl]benzimidazole
CID 159931088
2-[3-(10b,10c-Dihydropyren-4-yl)-5-pyridin-3-ylphenyl]-1,3-benzothiazole;5-[6-(1-phenylbenzimidazol-2-yl)-2-pyridin-3-ylpyrimidin-4-yl]-1,10-phenanthroline;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-1,3-benzoxazole;2-(4-pyridin-3-yl-6-pyrimidin-2-yl-1,3,5-triazin-2-yl)-6-(trifluoromethyl)-1,3-benzoxazole
CID 160449291
CID 161814794
CID 161814794
12-Dibenzothiophen-4-yl-23-thia-10-azahexacyclo[12.11.0.02,11.03,8.016,24.017,22]pentacosa-1(25),2(11),3,5,7,9,12,14,16(24),17,19,21-dodecaene;20-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-18-methyl-10-oxa-15-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;17-methyl-20-(9-phenylcarbazol-3-yl)-10-thia-15,18-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene;15-methyl-20-[9-[4-(trifluoromethyl)phenyl]carbazol-3-yl]-10-thia-18-azapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14,16,18,20-decaene
CID 161901264
1-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;1-[4-methyl-3-[(9-methyl-2-pyridin-4-ylpurin-6-yl)amino]phenyl]-2-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]ethanone;N-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethoxy)benzamide;N-[4-methyl-3-[(9-methyl-2-pyridin-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-[(9-methyl-2-thiophen-3-ylpurin-6-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
CID 161981800
4,12-dimethyl-8-oxa-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5,8-dimethylpyrido[4,3-b]indole;2,6-dimethylquinazoline;4,12-dimethyl-8-thia-6,10-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methylbenzene-1,3-dicarbonitrile;9-methyl-N,N-diphenylcarbazol-3-amine;9-methyl-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine;2,2,2-trifluoro-1-(3-methylphenyl)ethanone;2,2,2-trifluoro-1-(4-methylphenyl)ethanone;3,6,9-trimethylcarbazole
CID 162188772
2-(5-tert-butyl-2-methylbenzimidazol-1-yl)-N,N-dimethylethanamine;N,N-dimethyl-2-(6-propan-2-yl-1-benzofuran-3-yl)ethanamine;N,N-dimethyl-2-(6-propan-2-yl-1-benzothiophen-3-yl)ethanamine;N,N-dimethyl-1-(7-propan-2-yl-1,3-dihydro-2-benzothiophen-4-yl)piperidin-4-amine;N,N-dimethyl-1-(4-propan-2-yl-2,3-dihydro-1H-pyrrolo[3,2-c]pyridin-7-yl)piperidin-4-amine;N,N-dimethyl-2-(5-propan-2-ylimidazo[4,5-b]pyridin-1-yl)ethanamine;N,N-dimethyl-2-(5-propan-2-ylindol-1-yl)ethanamine;N,N-dimethyl-2-(5-propan-2-ylpyrrolo[3,2-b]pyridin-1-yl)ethanamine;N,N-dimethyl-2-[5-propan-2-yl-2-(trifluoromethyl)benzimidazol-1-yl]ethanamine
CID 167592122

Frequently Asked Questions

What is the IUPAC name of 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole?
The IUPAC name of 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole (CID 158571148) is 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole.
What is the SMILES notation for 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole?
The canonical SMILES for 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccc(-c6ccccc6)o5)c34)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7ccccc7)o6)c5cc43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c(c6ccccc6n5-c5ccc(-c6ccccc6)o5)c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(-c7ccccn7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccc(N(c7ccccc7)c7ccccc7)c6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6cccs6)c5c43)n2)cc1.
What is the InChIKey of 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole?
The InChIKey is HSCCCQAXTTUFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C52H35N5.C44H28N6.3C44H28N4O.C38H24N4S/c1-5-18-36(19-6-1)46-35-47(37-20-7-2-8-21-37)54-52(53-46)57-49-31-16-14-29-43(49)45-33-32-44-42-28-13-15-30-48(42)56(50(44)51(45)57)41-27-17-26-40(34-41)55(38-22-9-3-10-23-38)39-24-11-4-12-25-39;1-3-14-29(15-4-1)37-28-38(30-16-5-2-6-17-30)48-44(47-37)50-40-23-10-8-19-32(40)34-26-25-33-31-18-7-9-22-39(31)49(42(33)43(34)50)41-24-13-21-36(46-41)35-20-11-12-27-45-35;1-4-14-29(15-5-1)36-27-37(30-16-6-2-7-17-30)46-44(45-36)48-39-23-13-11-21-33(39)35-26-34-32-20-10-12-22-38(32)47(40(34)28-41(35)48)43-25-24-42(49-43)31-18-8-3-9-19-31;1-4-14-29(15-5-1)35-28-36(30-16-6-2-7-17-30)46-44(45-35)47-38-23-13-11-21-34(38)42-39(47)25-24-33-32-20-10-12-22-37(32)48(43(33)42)41-27-26-40(49-41)31-18-8-3-9-19-31;1-4-14-29(15-5-1)35-28-36(30-16-6-2-7-17-30)46-44(45-35)48-37-22-12-10-20-32(37)33-24-25-39-42(43(33)48)34-21-11-13-23-38(34)47(39)41-27-26-40(49-41)31-18-8-3-9-19-31;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)40-38(39-31)42-34-19-10-8-17-28(34)30-22-21-29-27-16-7-9-18-33(27)41(36(29)37(30)42)35-20-11-23-43-35/h1-35H;1-28H;3*1-28H;1-24H.
What are the key properties of 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole?
3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole has a molecular weight of 3825.55 g/mol, XLogP of 67.80, 31 rotatable bonds, 0 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[12-(4,6-diphenylpyrimidin-2-yl)indolo[2,3-a]carbazol-11-yl]-N,N-diphenylaniline;5-(4,6-diphenylpyrimidin-2-yl)-7-(5-phenylfuran-2-yl)indolo[2,3-b]carbazole;5-(4,6-diphenylpyrimidin-2-yl)-12-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-5-(5-phenylfuran-2-yl)indolo[3,2-c]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(6-pyridin-2-yl-2-pyridinyl)indolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-thiophen-2-ylindolo[2,3-a]carbazole is sourced from PubChem (CID 158571148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).