1-oxo-N-(propan-2-yl)-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
1-oxo-N-(propan-2-yl)-1H-2-benzothiopyran-3-carboxamide
1-oxo-N-(propan-2-yl)-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | D443-2504 |
| Compound Name: | 1-oxo-N-(propan-2-yl)-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 247.31 |
| Molecular Formula: | C13 H13 N O2 S |
| Smiles: | CC(C)NC(C1=Cc2ccccc2C(=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4071 |
| logD: | 2.4071 |
| logSw: | -2.8862 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.891 |
| InChI Key: | QIFFDAFFOPQMKF-UHFFFAOYSA-N |