N-{5-[(4-ethylphenyl)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-ethylphenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
N-{5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide
Compound characteristics
| Compound ID: | D136-0116 |
| Compound Name: | N-{5-[(4-ethylphenyl)methyl]-1,3-thiazol-2-yl}-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C28 H24 N2 O3 S |
| Smiles: | CCc1ccc(Cc2cnc(NC(c3ccc4C(=O)OC(Cc4c3)c3ccccc3)=O)s2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.9523 |
| logD: | 6.7591 |
| logSw: | -5.572 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.179 |
| InChI Key: | QXPRDEPWIXTUJE-RUZDIDTESA-N |