N-(4-methoxyphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-methoxyphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
N-(4-methoxyphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | D443-2382 |
| Compound Name: | N-(4-methoxyphenyl)-1-oxo-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 311.36 |
| Molecular Formula: | C17 H13 N O3 S |
| Smiles: | COc1ccc(cc1)NC(C1=Cc2ccccc2C(=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5893 |
| logD: | 3.5892 |
| logSw: | -3.9217 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.867 |
| InChI Key: | QRQZXHQNHHXKKN-UHFFFAOYSA-N |