C47H31N5 — CID 144769349
9-[2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-3-phenylimidazo[4,5-b]pyridin-7-yl]carbazole (PubChem CID 144769349) has the molecular formula C47H31N5 and a molecular weight of 665.80 g/mol. Its IUPAC name is 9-[2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-3-phenylimidazo[4,5-b]pyridin-7-yl]carbazole.
| Compound Name | 9-[2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-3-phenylimidazo[4,5-b]pyridin-7-yl]carbazole |
|---|---|
| PubChem CID | 144769349 |
| Molecular Formula | C47H31N5 |
| Molecular Weight | 665.80 g/mol |
| Exact Mass | 665.26 |
| IUPAC Name | 9-[2-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-3-phenylimidazo[4,5-b]pyridin-7-yl]carbazole |
| SMILES | c1ccc(-c2cc(-c3ccc(-c4nc5c(-n6c7ccccc7c7ccccc76)ccnc5n4-c4ccccc4)cc3)cc(-c3ccccc3)n2)cc1 |
| InChI | InChI=1S/C47H31N5/c1-4-14-33(15-5-1)40-30-36(31-41(49-40)34-16-6-2-7-17-34)32-24-26-35(27-25-32)46-50-45-44(28-29-48-47(45)51(46)37-18-8-3-9-19-37)52-42-22-12-10-20-38(42)39-21-11-13-23-43(39)52/h1-31H |
| InChIKey | SXVVFOAKKQSOHA-UHFFFAOYSA-N |
| XLogP | 11.58 |
| TPSA | 48.53 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 52 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 665.80 |
| LogP ≤ 5 | 11.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |