12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole

C355H235N45O3 — CID 158348799

About 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole

12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole (PubChem CID 158348799) has the molecular formula C355H235N45O3 and a molecular weight of 5179.10 g/mol. Its IUPAC name is 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole.

Molecular Properties

• Compound Name: 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole
• PubChem CID: 158348799
• Molecular Formula: C355H235N45O3
• Molecular Weight: 5179.10 g/mol
• Exact Mass: 5174.96
• IUPAC Name: 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole
• SMILES: COc1cc(C)cc(-c2cc(-c3cc(OC)cc(OC)c3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)c1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncccn6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncncn6)c5c43)n2)cc1.c1ccc(-c2ccnc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1
• InChI: InChI=1S/C64H44N6.2C49H31N7.C44H34N4O3.C40H26N4.C38H24N6.C37H23N7.C34H22N4/c1-6-20-47(21-7-1)67(48-22-8-2-9-23-48)52-38-34-45(35-39-52)58-44-59(46-36-40-53(41-37-46)68(49-24-10-3-11-25-49)50-26-12-4-13-27-50)66-64(65-58)70-61-33-19-17-31-55(61)57-43-42-56-54-30-16-18-32-60(54)69(62(56)63(57)70)51-28-14-5-15-29-51;2*1-5-17-32(18-6-1)40-31-41(33-19-7-2-8-20-33)51-48(50-40)55-42-27-15-13-25-36(42)38-29-30-39-37-26-14-16-28-43(37)56(45(39)44(38)55)49-53-46(34-21-9-3-10-22-34)52-47(54-49)35-23-11-4-12-24-35;1-27-20-28(22-31(21-27)49-2)38-26-39(29-23-32(50-3)25-33(24-29)51-4)46-44(45-38)48-41-17-11-9-15-35(41)37-19-18-36-34-14-8-10-16-40(34)47(42(36)43(37)48)30-12-6-5-7-13-30;1-4-14-27(15-5-1)34-26-35(28-16-6-2-7-17-28)42-40(41-34)44-37-23-13-11-21-31(37)33-25-24-32-30-20-10-12-22-36(30)43(38(32)39(33)44)29-18-8-3-9-19-29;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)42-38(41-31)44-34-19-10-8-17-28(34)30-21-20-29-27-16-7-9-18-33(27)43(35(29)36(30)44)37-39-22-11-23-40-37;1-3-11-24(12-4-1)30-21-31(25-13-5-2-6-14-25)42-37(41-30)44-33-18-10-8-16-27(33)29-20-19-28-26-15-7-9-17-32(26)43(34(28)35(29)44)36-39-22-38-23-40-36;1-3-11-23(12-4-1)29-21-22-35-34(36-29)38-31-18-10-8-16-26(31)28-20-19-27-25-15-7-9-17-30(25)37(32(27)33(28)38)24-13-5-2-6-14-24/h1-44H;2*1-31H;5-26H,1-4H3;1-26H;1-24H;1-23H;1-22H
• InChIKey: GSBFWHSRKWULEC-UHFFFAOYSA-N
• XLogP: 85.66
• TPSA: 461.08 Ų
• H-Bond Acceptors: 48
• Rotatable Bonds: 44
• Heavy Atoms: 403
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5179.10
LogP ≤ 5	85.66
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	48

Frequently Asked Questions

What is the IUPAC name of 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?

The IUPAC name of 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole (CID 158348799) is 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole.

What is the SMILES notation for 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?

The canonical SMILES for 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole is COc1cc(C)cc(-c2cc(-c3cc(OC)cc(OC)c3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)c1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncccn6)c5c43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ncncn6)c5c43)n2)cc1.c1ccc(-c2ccnc(-n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)n2)cc1.c1ccc(N(c2ccccc2)c2ccc(-c3cc(-c4ccc(N(c5ccccc5)c5ccccc5)cc4)nc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)n3)cc2)cc1.

What is the InChIKey of 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?

The InChIKey is GSBFWHSRKWULEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H44N6.2C49H31N7.C44H34N4O3.C40H26N4.C38H24N6.C37H23N7.C34H22N4/c1-6-20-47(21-7-1)67(48-22-8-2-9-23-48)52-38-34-45(35-39-52)58-44-59(46-36-40-53(41-37-46)68(49-24-10-3-11-25-49)50-26-12-4-13-27-50)66-64(65-58)70-61-33-19-17-31-55(61)57-43-42-56-54-30-16-18-32-60(54)69(62(56)63(57)70)51-28-14-5-15-29-51;2*1-5-17-32(18-6-1)40-31-41(33-19-7-2-8-20-33)51-48(50-40)55-42-27-15-13-25-36(42)38-29-30-39-37-26-14-16-28-43(37)56(45(39)44(38)55)49-53-46(34-21-9-3-10-22-34)52-47(54-49)35-23-11-4-12-24-35;1-27-20-28(22-31(21-27)49-2)38-26-39(29-23-32(50-3)25-33(24-29)51-4)46-44(45-38)48-41-17-11-9-15-35(41)37-19-18-36-34-14-8-10-16-40(34)47(42(36)43(37)48)30-12-6-5-7-13-30;1-4-14-27(15-5-1)34-26-35(28-16-6-2-7-17-28)42-40(41-34)44-37-23-13-11-21-31(37)33-25-24-32-30-20-10-12-22-36(30)43(38(32)39(33)44)29-18-8-3-9-19-29;1-3-12-25(13-4-1)31-24-32(26-14-5-2-6-15-26)42-38(41-31)44-34-19-10-8-17-28(34)30-21-20-29-27-16-7-9-18-33(27)43(35(29)36(30)44)37-39-22-11-23-40-37;1-3-11-24(12-4-1)30-21-31(25-13-5-2-6-14-25)42-37(41-30)44-33-18-10-8-16-27(33)29-20-19-28-26-15-7-9-17-32(26)43(34(28)35(29)44)36-39-22-38-23-40-36;1-3-11-23(12-4-1)29-21-22-35-34(36-29)38-31-18-10-8-16-26(31)28-20-19-27-25-15-7-9-17-30(25)37(32(27)33(28)38)24-13-5-2-6-14-24/h1-44H;2*1-31H;5-26H,1-4H3;1-26H;1-24H;1-23H;1-22H.

What are the key properties of 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole?

12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole has a molecular weight of 5179.10 g/mol, XLogP of 85.66, 44 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.

Where does this data come from?

All data for 12-[4-(3,5-dimethoxyphenyl)-6-(3-methoxy-5-methylphenyl)pyrimidin-2-yl]-11-phenylindolo[2,3-a]carbazole;N,N-diphenyl-4-[6-[4-(N-phenylanilino)phenyl]-2-(11-phenylindolo[2,3-a]carbazol-12-yl)pyrimidin-4-yl]aniline;bis(11-(4,6-diphenylpyrimidin-2-yl)-12-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[2,3-a]carbazole);12-(4,6-diphenylpyrimidin-2-yl)-11-phenylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-pyrimidin-2-ylindolo[2,3-a]carbazole;12-(4,6-diphenylpyrimidin-2-yl)-11-(1,3,5-triazin-2-yl)indolo[2,3-a]carbazole;11-phenyl-12-(4-phenylpyrimidin-2-yl)indolo[2,3-a]carbazole is sourced from PubChem (CID 158348799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).