C58H38N2O — CID 170298890
N-[2-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-3-amine (PubChem CID 170298890) has the molecular formula C58H38N2O and a molecular weight of 778.96 g/mol. Its IUPAC name is N-[2-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-3-amine.
| Compound Name | N-[2-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-3-amine |
|---|---|
| PubChem CID | 170298890 |
| Molecular Formula | C58H38N2O |
| Molecular Weight | 778.96 g/mol |
| Exact Mass | 778.30 |
| IUPAC Name | N-[2-(9-phenylcarbazol-3-yl)phenyl]-N-[2-(8-phenylnaphthalen-1-yl)phenyl]dibenzofuran-3-amine |
| SMILES | c1ccc(-c2cccc3cccc(-c4ccccc4N(c4ccc5c(c4)oc4ccccc45)c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c23)cc1 |
| InChI | InChI=1S/C58H38N2O/c1-3-17-39(18-4-1)45-27-15-19-40-20-16-28-50(58(40)45)46-24-8-12-30-53(46)60(43-34-35-49-48-26-10-14-32-56(48)61-57(49)38-43)52-29-11-7-23-44(52)41-33-36-55-51(37-41)47-25-9-13-31-54(47)59(55)42-21-5-2-6-22-42/h1-38H |
| InChIKey | LCVHENBDVBZAEX-UHFFFAOYSA-N |
| XLogP | 16.31 |
| TPSA | 21.31 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 61 |
| Complexity | — |
2 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 778.96 |
| LogP ≤ 5 | 16.31 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |