N-(2-methoxyethyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-(2-methoxyethyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | G777-0049 |
| Compound Name: | N-(2-methoxyethyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 265.33 |
| Molecular Formula: | C13 H15 N O3 S |
| Smiles: | COCCNC(c1cccc2C(CCSc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4874 |
| logD: | 1.4874 |
| logSw: | -2.2607 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.276 |
| InChI Key: | DCDJVBOMXKTYKL-UHFFFAOYSA-N |