N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 7656-0871 |
| Compound Name: | N-{5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}-7-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 412.89 |
| Molecular Formula: | C21 H17 Cl N2 O3 S |
| Smiles: | Cc1ccc2CC(C(Nc3ncc(Cc4ccccc4[Cl])s3)=O)OC(c2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5386 |
| logD: | 5.5323 |
| logSw: | -5.7911 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.45 |
| InChI Key: | ITIVOMMVIRTQNM-SFHVURJKSA-N |