N-[(3-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-[(3-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0198 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 327.4 |
| Molecular Formula: | C18 H17 N O3 S |
| Smiles: | COc1cccc(CNC(c2cccc3C(CCSc23)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.0918 |
| logD: | 3.0918 |
| logSw: | -3.6245 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.364 |
| InChI Key: | YYYNFYVKYXATBY-UHFFFAOYSA-N |