N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K953-0020 |
| Compound Name: | N-[4-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 486.53 |
| Molecular Formula: | C31 H22 N2 O4 |
| Smiles: | Cc1ccc(cc1)C1=C(C(Nc2ccc(cc2)c2nc3ccc(C)cc3o2)=O)OC(c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5285 |
| logD: | 6.5285 |
| logSw: | -5.6866 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.869 |
| InChI Key: | HVOJKUQPWTVGGQ-UHFFFAOYSA-N |