C132H86N11OP — CID 159236321
6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline (PubChem CID 159236321) has the molecular formula C132H86N11OP and a molecular weight of 1873.19 g/mol. Its IUPAC name is 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline.
| Compound Name | 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline |
|---|---|
| PubChem CID | 159236321 |
| Molecular Formula | C132H86N11OP |
| Molecular Weight | 1873.19 g/mol |
| Exact Mass | 1871.68 |
| IUPAC Name | 6-(4-diphenylphosphorylphenyl)-7-phenylindolo[2,3-c]quinoline;6-[4-(2,6-diphenylpyrimidin-4-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline;6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-7-phenylindolo[2,3-c]quinoline |
| SMILES | O=P(c1ccccc1)(c1ccccc1)c1ccc(-c2nc3ccccc3c3c4ccccc4n(-c4ccccc4)c23)cc1.c1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)nc(-c3ccccc3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4nc5ccccc5c5c6ccccc6n(-c6ccccc6)c45)c4ccccc34)n2)cc1 |
| InChI | InChI=1S/C47H30N4.C46H29N5.C39H27N2OP/c1-4-16-31(17-5-1)41-30-42(50-47(49-41)32-18-6-2-7-19-32)36-28-29-37(35-23-11-10-22-34(35)36)45-46-44(38-24-12-14-26-40(38)48-45)39-25-13-15-27-43(39)51(46)33-20-8-3-9-21-33;1-4-16-30(17-5-1)44-48-45(31-18-6-2-7-19-31)50-46(49-44)36-29-28-35(33-22-10-11-23-34(33)36)42-43-41(37-24-12-14-26-39(37)47-42)38-25-13-15-27-40(38)51(43)32-20-8-3-9-21-32;42-43(30-16-6-2-7-17-30,31-18-8-3-9-19-31)32-26-24-28(25-27-32)38-39-37(33-20-10-12-22-35(33)40-38)34-21-11-13-23-36(34)41(39)29-14-4-1-5-15-29/h1-30H;1-29H;1-27H |
| InChIKey | KTNCBPZLMUMGHT-UHFFFAOYSA-N |
| XLogP | 31.92 |
| TPSA | 134.98 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 12 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 145 |
| Complexity | — |
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1873.19 |
| LogP ≤ 5 | 31.92 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 12 |
| Structural Alerts | {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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