C118H74N12 — CID 159077338
7-phenyl-10-(7-phenylindolo[2,3-c]quinolin-10-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[3,2-b]indol-8-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[2,3-c]quinoline (PubChem CID 159077338) has the molecular formula C118H74N12 and a molecular weight of 1659.97 g/mol. Its IUPAC name is 7-phenyl-10-(7-phenylindolo[2,3-c]quinolin-10-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[3,2-b]indol-8-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[2,3-c]quinoline.
| Compound Name | 7-phenyl-10-(7-phenylindolo[2,3-c]quinolin-10-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[3,2-b]indol-8-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[2,3-c]quinoline |
|---|---|
| PubChem CID | 159077338 |
| Molecular Formula | C118H74N12 |
| Molecular Weight | 1659.97 g/mol |
| Exact Mass | 1658.62 |
| IUPAC Name | 7-phenyl-10-(7-phenylindolo[2,3-c]quinolin-10-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[3,2-b]indol-8-yl)indolo[2,3-c]quinoline;7-phenyl-10-(5-phenylpyrido[4,3-b]indol-8-yl)indolo[2,3-c]quinoline |
| SMILES | c1ccc(-n2c3ccc(-c4ccc5c(c4)c4c6ccccc6ncc4n5-c4ccccc4)cc3c3c4ccccc4ncc32)cc1.c1ccc(-n2c3ccc(-c4ccc5c(c4)c4c6ccccc6ncc4n5-c4ccccc4)cc3c3ncccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4c6ccccc6ncc4n5-c4ccccc4)ccc32)cc1 |
| InChI | InChI=1S/C42H26N4.2C38H24N4/c1-3-11-29(12-4-1)45-37-21-19-27(23-33(37)41-31-15-7-9-17-35(31)43-25-39(41)45)28-20-22-38-34(24-28)42-32-16-8-10-18-36(32)44-26-40(42)46(38)30-13-5-2-6-14-30;1-3-10-27(11-4-1)41-34-20-18-26(23-31(34)38-35(41)16-9-21-39-38)25-17-19-33-30(22-25)37-29-14-7-8-15-32(29)40-24-36(37)42(33)28-12-5-2-6-13-28;1-3-9-27(10-4-1)41-34-17-15-25(21-30(34)32-23-39-20-19-36(32)41)26-16-18-35-31(22-26)38-29-13-7-8-14-33(29)40-24-37(38)42(35)28-11-5-2-6-12-28/h1-26H;2*1-24H |
| InChIKey | KAKMAIYKXJHOOK-UHFFFAOYSA-N |
| XLogP | 29.63 |
| TPSA | 106.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 130 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1659.97 |
| LogP ≤ 5 | 29.63 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |