C207H150N20O2 — CID 158573476
5-[4-[3,5-bis(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole;9-(3-carbazol-9-ylphenyl)carbazole;8-methoxy-5-[4-[4-(8-methoxypyrido[3,2-b]indol-5-yl)-2-methylphenyl]-3-methylphenyl]pyrido[3,2-b]indole;5-[[4-[4-(pyrido[3,2-b]indol-5-ylmethyl)phenyl]phenyl]methyl]pyrido[3,2-b]indole;2-[4-[2-[4-[2-(4-pyrido[3,4-b]indol-2-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[3,4-b]indole (PubChem CID 158573476) has the molecular formula C207H150N20O2 and a molecular weight of 2949.61 g/mol. Its IUPAC name is 5-[4-[3,5-bis(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole;9-(3-carbazol-9-ylphenyl)carbazole;8-methoxy-5-[4-[4-(8-methoxypyrido[3,2-b]indol-5-yl)-2-methylphenyl]-3-methylphenyl]pyrido[3,2-b]indole;5-[[4-[4-(pyrido[3,2-b]indol-5-ylmethyl)phenyl]phenyl]methyl]pyrido[3,2-b]indole;2-[4-[2-[4-[2-(4-pyrido[3,4-b]indol-2-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[3,4-b]indole.
| Compound Name | 5-[4-[3,5-bis(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole;9-(3-carbazol-9-ylphenyl)carbazole;8-methoxy-5-[4-[4-(8-methoxypyrido[3,2-b]indol-5-yl)-2-methylphenyl]-3-methylphenyl]pyrido[3,2-b]indole;5-[[4-[4-(pyrido[3,2-b]indol-5-ylmethyl)phenyl]phenyl]methyl]pyrido[3,2-b]indole;2-[4-[2-[4-[2-(4-pyrido[3,4-b]indol-2-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[3,4-b]indole |
|---|---|
| PubChem CID | 158573476 |
| Molecular Formula | C207H150N20O2 |
| Molecular Weight | 2949.61 g/mol |
| Exact Mass | 2947.23 |
| IUPAC Name | 5-[4-[3,5-bis(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole;9-(3-carbazol-9-ylphenyl)carbazole;8-methoxy-5-[4-[4-(8-methoxypyrido[3,2-b]indol-5-yl)-2-methylphenyl]-3-methylphenyl]pyrido[3,2-b]indole;5-[[4-[4-(pyrido[3,2-b]indol-5-ylmethyl)phenyl]phenyl]methyl]pyrido[3,2-b]indole;2-[4-[2-[4-[2-(4-pyrido[3,4-b]indol-2-ylphenyl)propan-2-yl]phenyl]propan-2-yl]phenyl]pyrido[3,4-b]indole |
| SMILES | CC(C)(c1ccc(-n2ccc3c4ccccc4nc-3c2)cc1)c1ccc(C(C)(C)c2ccc(-n3ccc4c5ccccc5nc-4c3)cc2)cc1.COc1ccc2c(c1)c1ncccc1n2-c1ccc(-c2ccc(-n3c4ccc(OC)cc4c4ncccc43)cc2C)c(C)c1.c1cc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)c1.c1ccc2c(c1)c1ncccc1n2-c1ccc(-c2cc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)cc(-c3ccc(-n4c5ccccc5c5ncccc54)cc3)c2)cc1.c1ccc2c(c1)c1ncccc1n2Cc1ccc(-c2ccc(Cn3c4ccccc4c4ncccc43)cc2)cc1 |
| InChI | InChI=1S/C57H36N6.C46H38N4.C38H30N4O2.C36H26N4.C30H20N2/c1-4-13-49-46(10-1)55-52(16-7-31-58-55)61(49)43-25-19-37(20-26-43)40-34-41(38-21-27-44(28-22-38)62-50-14-5-2-11-47(50)56-53(62)17-8-32-59-56)36-42(35-40)39-23-29-45(30-24-39)63-51-15-6-3-12-48(51)57-54(63)18-9-33-60-57;1-45(2,33-17-21-35(22-18-33)49-27-25-39-37-9-5-7-11-41(37)47-43(39)29-49)31-13-15-32(16-14-31)46(3,4)34-19-23-36(24-20-34)50-28-26-40-38-10-6-8-12-42(38)48-44(40)30-50;1-23-19-25(41-33-15-11-27(43-3)21-31(33)37-35(41)7-5-17-39-37)9-13-29(23)30-14-10-26(20-24(30)2)42-34-16-12-28(44-4)22-32(34)38-36(42)8-6-18-40-38;1-3-9-31-29(7-1)35-33(11-5-21-37-35)39(31)23-25-13-17-27(18-14-25)28-19-15-26(16-20-28)24-40-32-10-4-2-8-30(32)36-34(40)12-6-22-38-36;1-5-16-27-23(12-1)24-13-2-6-17-28(24)31(27)21-10-9-11-22(20-21)32-29-18-7-3-14-25(29)26-15-4-8-19-30(26)32/h1-36H;5-30H,1-4H3;5-22H,1-4H3;1-22H,23-24H2;1-20H |
| InChIKey | HSJGHDYQQXVPSB-UHFFFAOYSA-N |
| XLogP | 50.70 |
| TPSA | 188.70 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 22 |
| Rotatable Bonds | 24 |
| Heavy Atoms | 229 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2949.61 |
| LogP ≤ 5 | 50.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 22 |