C58H38N2O — CID 176608759
4-(2-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine (PubChem CID 176608759) has the molecular formula C58H38N2O and a molecular weight of 778.96 g/mol. Its IUPAC name is 4-(2-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine.
| Compound Name | 4-(2-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine |
|---|---|
| PubChem CID | 176608759 |
| Molecular Formula | C58H38N2O |
| Molecular Weight | 778.96 g/mol |
| Exact Mass | 778.30 |
| IUPAC Name | 4-(2-carbazol-9-ylphenyl)-N-(3-naphthalen-2-ylphenyl)-N-(3-phenylphenyl)dibenzofuran-1-amine |
| SMILES | c1ccc(-c2cccc(N(c3cccc(-c4ccc5ccccc5c4)c3)c3ccc(-c4ccccc4-n4c5ccccc5c5ccccc54)c4oc5ccccc5c34)c2)cc1 |
| InChI | InChI=1S/C58H38N2O/c1-2-16-39(17-3-1)42-20-14-22-45(37-42)59(46-23-15-21-43(38-46)44-33-32-40-18-4-5-19-41(40)36-44)55-35-34-50(58-57(55)51-27-9-13-31-56(51)61-58)49-26-8-12-30-54(49)60-52-28-10-6-24-47(52)48-25-7-11-29-53(48)60/h1-38H |
| InChIKey | HGOGOCKGEDGCIQ-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 |