N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Chemical Structure Depiction of
N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | D136-0096 |
| Compound Name: | N-{5-[(4-chlorophenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide |
| Molecular Weight: | 474.96 |
| Molecular Formula: | C26 H19 Cl N2 O3 S |
| Smiles: | C1C(c2ccccc2)OC(c2ccc(cc12)C(Nc1ncc(Cc2ccc(cc2)[Cl])s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6164 |
| logD: | 6.4231 |
| logSw: | -6.3863 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.179 |
| InChI Key: | HRIYSGPPKDEAEW-HSZRJFAPSA-N |