N-(4-bromo-2-methylphenyl)-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-bromo-2-methylphenyl)-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
N-(4-bromo-2-methylphenyl)-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | K953-0101 |
| Compound Name: | N-(4-bromo-2-methylphenyl)-4-(4-methylphenyl)-1-oxo-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 448.31 |
| Molecular Formula: | C24 H18 Br N O3 |
| Smiles: | Cc1ccc(cc1)C1=C(C(Nc2ccc(cc2C)[Br])=O)OC(c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7167 |
| logD: | 5.7151 |
| logSw: | -5.5479 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.361 |
| InChI Key: | WIVWXRBWMLPYRU-UHFFFAOYSA-N |