N-methyl-N-(3-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Chemical Structure Depiction of
N-methyl-N-(3-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
N-methyl-N-(3-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide
Compound characteristics
| Compound ID: | E213-1351 |
| Compound Name: | N-methyl-N-(3-methylphenyl)-4-oxo-3,4-dihydro-2H-1-benzothiopyran-8-carboxamide |
| Molecular Weight: | 311.4 |
| Molecular Formula: | C18 H17 N O2 S |
| Smiles: | Cc1cccc(c1)N(C)C(c1cccc2C(CCSc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4495 |
| logD: | 3.4495 |
| logSw: | -3.7886 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 28.7759 |
| InChI Key: | LBKVRVHXNQKWFA-UHFFFAOYSA-N |