N-(2-methoxy-5-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-(2-methoxy-5-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-(2-methoxy-5-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | E213-1299 |
| Compound Name: | N-(2-methoxy-5-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 327.4 |
| Molecular Formula: | C18 H17 N O3 S |
| Smiles: | Cc1ccc(c(c1)NC(c1cccc2C(CCSc12)=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.066 |
| logD: | 3.0635 |
| logSw: | -3.5761 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.431 |
| InChI Key: | OYTLEKVQBUGVCK-UHFFFAOYSA-N |