N-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0382 |
| Compound Name: | N-[(2,4-dimethoxyphenyl)methyl]-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C19 H19 N O4 S |
| Smiles: | COc1ccc(CNC(c2cccc3C(CCSc23)=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2141 |
| logD: | 3.2141 |
| logSw: | -3.6818 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.994 |
| InChI Key: | MNJQTPDBTMBOEP-UHFFFAOYSA-N |