12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene

C371H253N47O2S2 — CID 158517068

About 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene

12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene (PubChem CID 158517068) has the molecular formula C371H253N47O2S2 and a molecular weight of 5465.57 g/mol. Its IUPAC name is 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene.

Molecular Properties

• Compound Name: 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene
• PubChem CID: 158517068
• Molecular Formula: C371H253N47O2S2
• Molecular Weight: 5465.57 g/mol
• Exact Mass: 5461.06
• IUPAC Name: 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene
• SMILES: Cc1cc(-n2c3ccccc3c3ccccc32)ccc1-c1ccc(-n2c3ccccc3c3cnccc32)cc1C.Cc1cc(-n2c3ccccc3c3ccccc32)ccc1-c1ccc(-n2c3nc4ccccc4nc3c3nc4ccccc4nc32)cc1C.Cc1cc(-n2c3ccccc3c3cnccc32)ccc1-c1cc(C)c(-c2ccc(-n3c4ccccc4c4cnccc43)cc2C)cc1C.Cc1cc(-n2c3ccccc3c3cnccc32)ccc1-c1ccc(-n2c3ccccc3c3cnccc32)cc1C.c1cc2c(cn1)Cc1cnccc1N2c1ccc(-c2ccc(N3c4ccncc4Cc4cnccc43)cc2)cc1.c1cc2c(cn1)Oc1cnccc1N2c1ccc(-c2ccc(N3c4ccncc4Oc4cnccc43)cc2)cc1.c1cc2c(cn1)Sc1cnccc1N2c1ccc(-c2ccc(N3c4ccncc4Sc4cnccc43)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cnccc2n3-c2ccc(-c3ccc(-n4c5ccncc5c5cc(-c6ccccc6)ccc54)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccncc4c4cccnc43)cc2)cc1.c1ccc2c(c1)c1cnccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4cnccc43)cc2)cc1
• InChI: InChI=1S/C46H30N4.C44H34N4.C42H28N6.C37H27N3.C36H26N4.C34H24N6.2C34H22N4.C32H20N6O2.C32H20N6S2/c1-3-7-31(8-4-1)35-15-21-43-39(27-35)41-29-47-25-23-45(41)49(43)37-17-11-33(12-18-37)34-13-19-38(20-14-34)50-44-22-16-36(32-9-5-2-6-10-32)28-40(44)42-30-48-26-24-46(42)50;1-27-21-31(47-41-11-7-5-9-35(41)39-25-45-19-17-43(39)47)13-15-33(27)37-23-30(4)38(24-29(37)3)34-16-14-32(22-28(34)2)48-42-12-8-6-10-36(42)40-26-46-20-18-44(40)48;1-25-23-27(47-37-17-9-3-11-31(37)32-12-4-10-18-38(32)47)19-21-29(25)30-22-20-28(24-26(30)2)48-41-39(43-33-13-5-7-15-35(33)45-41)40-42(48)46-36-16-8-6-14-34(36)44-40;1-24-21-26(39-34-12-6-3-9-30(34)31-10-4-7-13-35(31)39)15-17-28(24)29-18-16-27(22-25(29)2)40-36-14-8-5-11-32(36)33-23-38-20-19-37(33)40;1-23-19-25(39-33-9-5-3-7-29(33)31-21-37-17-15-35(31)39)11-13-27(23)28-14-12-26(20-24(28)2)40-34-10-6-4-8-30(34)32-22-38-18-16-36(32)40;1-5-29(39-31-9-13-35-19-25(31)17-26-20-36-14-10-32(26)39)6-2-23(1)24-3-7-30(8-4-24)40-33-11-15-37-21-27(33)18-28-22-38-16-12-34(28)40;1-3-9-31-27(6-1)28-7-2-4-10-32(28)37(31)25-15-11-23(12-16-25)24-13-17-26(18-14-24)38-33-19-21-35-22-30(33)29-8-5-20-36-34(29)38;1-3-7-31-27(5-1)29-21-35-19-17-33(29)37(31)25-13-9-23(10-14-25)24-11-15-26(16-12-24)38-32-8-4-2-6-28(32)30-22-36-20-18-34(30)38;2*1-5-23(37-25-9-13-33-17-29(25)39-30-18-34-14-10-26(30)37)6-2-21(1)22-3-7-24(8-4-22)38-27-11-15-35-19-31(27)40-32-20-36-16-12-28(32)38/h1-30H;5-26H,1-4H3;3-24H,1-2H3;3-23H,1-2H3;3-22H,1-2H3;1-16,19-22H,17-18H2;2*1-22H;2*1-20H
• InChIKey: HLTILLGVVCWINK-UHFFFAOYSA-N
• XLogP: 92.72
• TPSA: 454.95 Ų
• H-Bond Acceptors: 51
• Rotatable Bonds: 33
• Heavy Atoms: 422
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	5465.57
LogP ≤ 5	92.72
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	51

Frequently Asked Questions

What is the IUPAC name of 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene?

The IUPAC name of 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene (CID 158517068) is 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene.

What is the SMILES notation for 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene?

The canonical SMILES for 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene is Cc1cc(-n2c3ccccc3c3ccccc32)ccc1-c1ccc(-n2c3ccccc3c3cnccc32)cc1C.Cc1cc(-n2c3ccccc3c3ccccc32)ccc1-c1ccc(-n2c3nc4ccccc4nc3c3nc4ccccc4nc32)cc1C.Cc1cc(-n2c3ccccc3c3cnccc32)ccc1-c1cc(C)c(-c2ccc(-n3c4ccccc4c4cnccc43)cc2C)cc1C.Cc1cc(-n2c3ccccc3c3cnccc32)ccc1-c1ccc(-n2c3ccccc3c3cnccc32)cc1C.c1cc2c(cn1)Cc1cnccc1N2c1ccc(-c2ccc(N3c4ccncc4Cc4cnccc43)cc2)cc1.c1cc2c(cn1)Oc1cnccc1N2c1ccc(-c2ccc(N3c4ccncc4Oc4cnccc43)cc2)cc1.c1cc2c(cn1)Sc1cnccc1N2c1ccc(-c2ccc(N3c4ccncc4Sc4cnccc43)cc2)cc1.c1ccc(-c2ccc3c(c2)c2cnccc2n3-c2ccc(-c3ccc(-n4c5ccncc5c5cc(-c6ccccc6)ccc54)cc3)cc2)cc1.c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccncc4c4cccnc43)cc2)cc1.c1ccc2c(c1)c1cnccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4cnccc43)cc2)cc1.

What is the InChIKey of 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene?

The InChIKey is HLTILLGVVCWINK-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H30N4.C44H34N4.C42H28N6.C37H27N3.C36H26N4.C34H24N6.2C34H22N4.C32H20N6O2.C32H20N6S2/c1-3-7-31(8-4-1)35-15-21-43-39(27-35)41-29-47-25-23-45(41)49(43)37-17-11-33(12-18-37)34-13-19-38(20-14-34)50-44-22-16-36(32-9-5-2-6-10-32)28-40(44)42-30-48-26-24-46(42)50;1-27-21-31(47-41-11-7-5-9-35(41)39-25-45-19-17-43(39)47)13-15-33(27)37-23-30(4)38(24-29(37)3)34-16-14-32(22-28(34)2)48-42-12-8-6-10-36(42)40-26-46-20-18-44(40)48;1-25-23-27(47-37-17-9-3-11-31(37)32-12-4-10-18-38(32)47)19-21-29(25)30-22-20-28(24-26(30)2)48-41-39(43-33-13-5-7-15-35(33)45-41)40-42(48)46-36-16-8-6-14-34(36)44-40;1-24-21-26(39-34-12-6-3-9-30(34)31-10-4-7-13-35(31)39)15-17-28(24)29-18-16-27(22-25(29)2)40-36-14-8-5-11-32(36)33-23-38-20-19-37(33)40;1-23-19-25(39-33-9-5-3-7-29(33)31-21-37-17-15-35(31)39)11-13-27(23)28-14-12-26(20-24(28)2)40-34-10-6-4-8-30(34)32-22-38-18-16-36(32)40;1-5-29(39-31-9-13-35-19-25(31)17-26-20-36-14-10-32(26)39)6-2-23(1)24-3-7-30(8-4-24)40-33-11-15-37-21-27(33)18-28-22-38-16-12-34(28)40;1-3-9-31-27(6-1)28-7-2-4-10-32(28)37(31)25-15-11-23(12-16-25)24-13-17-26(18-14-24)38-33-19-21-35-22-30(33)29-8-5-20-36-34(29)38;1-3-7-31-27(5-1)29-21-35-19-17-33(29)37(31)25-13-9-23(10-14-25)24-11-15-26(16-12-24)38-32-8-4-2-6-28(32)30-22-36-20-18-34(30)38;2*1-5-23(37-25-9-13-33-17-29(25)39-30-18-34-14-10-26(30)37)6-2-21(1)22-3-7-24(8-4-22)38-27-11-15-35-19-31(27)40-32-20-36-16-12-28(32)38/h1-30H;5-26H,1-4H3;3-24H,1-2H3;3-23H,1-2H3;3-22H,1-2H3;1-16,19-22H,17-18H2;2*1-22H;2*1-20H.

What are the key properties of 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene?

12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene has a molecular weight of 5465.57 g/mol, XLogP of 92.72, 33 rotatable bonds, 0 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for 12-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]-3,10,12,14,21-pentazapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;5-[4-(4-carbazol-9-yl-2-methylphenyl)-3-methylphenyl]pyrido[4,3-b]indole;8-[4-(4-carbazol-9-ylphenyl)phenyl]-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-[4-[2,5-dimethyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]-3-methylphenyl]pyrido[4,3-b]indole;5-[3-methyl-4-(2-methyl-4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;9-[4-[4-(2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-oxa-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene;8-phenyl-5-[4-[4-(8-phenylpyrido[4,3-b]indol-5-yl)phenyl]phenyl]pyrido[4,3-b]indole;5-[4-(4-pyrido[4,3-b]indol-5-ylphenyl)phenyl]pyrido[4,3-b]indole;5-[4-[4-(10H-pyrido[4,3-b][1,6]naphthyridin-5-yl)phenyl]phenyl]-10H-pyrido[4,3-b][1,6]naphthyridine;9-[4-[4-(2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaen-9-yl)phenyl]phenyl]-2-thia-5,9,13-triazatricyclo[8.4.0.03,8]tetradeca-1(10),3(8),4,6,11,13-hexaene is sourced from PubChem (CID 158517068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).