N-(5-chloro-2-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-(5-chloro-2-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | E213-1236 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 347.82 |
| Molecular Formula: | C17 H14 Cl N O3 S |
| Smiles: | COc1ccc(cc1NC(c1cccc2C(CCSc12)=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4819 |
| logD: | 3.2631 |
| logSw: | -3.8948 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.431 |
| InChI Key: | JUXRBCOAZKSYGY-UHFFFAOYSA-N |