4-oxo-N-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
4-oxo-N-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
4-oxo-N-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0084 |
| Compound Name: | 4-oxo-N-[4-(propan-2-yl)phenyl]-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 325.43 |
| Molecular Formula: | C19 H19 N O2 S |
| Smiles: | CC(C)c1ccc(cc1)NC(c1cccc2C(CCSc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.369 |
| logD: | 4.3688 |
| logSw: | -4.3372 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.498 |
| InChI Key: | UEWACTIWBIFOTK-UHFFFAOYSA-N |