C43H31N — CID 157272513
9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole (PubChem CID 157272513) has the molecular formula C43H31N and a molecular weight of 561.73 g/mol. Its IUPAC name is 9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole.
| Compound Name | 9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole |
|---|---|
| PubChem CID | 157272513 |
| Molecular Formula | C43H31N |
| Molecular Weight | 561.73 g/mol |
| Exact Mass | 561.25 |
| IUPAC Name | 9-phenyl-3-[4-[[4-(4-phenylphenyl)phenyl]methyl]phenyl]carbazole |
| SMILES | c1ccc(-c2ccc(-c3ccc(Cc4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc4)cc3)cc2)cc1 |
| InChI | InChI=1S/C43H31N/c1-3-9-33(10-4-1)35-23-25-36(26-24-35)34-19-15-31(16-20-34)29-32-17-21-37(22-18-32)38-27-28-43-41(30-38)40-13-7-8-14-42(40)44(43)39-11-5-2-6-12-39/h1-28,30H,29H2 |
| InChIKey | SSNOBMBZKGTOGK-UHFFFAOYSA-N |
| XLogP | 11.38 |
| TPSA | 4.93 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 44 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 561.73 |
| LogP ≤ 5 | 11.38 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |