N-(3-acetylphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
N-(3-acetylphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | D443-2412 |
| Compound Name: | N-(3-acetylphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 323.37 |
| Molecular Formula: | C18 H13 N O3 S |
| Smiles: | CC(c1cccc(c1)NC(C1=Cc2ccccc2C(=O)S1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3478 |
| logD: | 3.3473 |
| logSw: | -3.8157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.15 |
| InChI Key: | IOPWSSUCARCEMF-UHFFFAOYSA-N |