1-oxo-N-[4-(propan-2-yl)phenyl]-1H-2-benzothiopyran-3-carboxamide
Chemical Structure Depiction of
1-oxo-N-[4-(propan-2-yl)phenyl]-1H-2-benzothiopyran-3-carboxamide
1-oxo-N-[4-(propan-2-yl)phenyl]-1H-2-benzothiopyran-3-carboxamide
Compound characteristics
| Compound ID: | D443-2409 |
| Compound Name: | 1-oxo-N-[4-(propan-2-yl)phenyl]-1H-2-benzothiopyran-3-carboxamide |
| Molecular Weight: | 323.41 |
| Molecular Formula: | C19 H17 N O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(C1=Cc2ccccc2C(=O)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9451 |
| logD: | 4.9451 |
| logSw: | -4.5849 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.323 |
| InChI Key: | MJNMMNMDHQYFJP-UHFFFAOYSA-N |