6-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}-2H-1-benzopyran-3-carboxamide
6-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | G669-0275 |
| Compound Name: | 6-methoxy-N-{[4-(methylsulfanyl)phenyl]methyl}-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 341.43 |
| Molecular Formula: | C19 H19 N O3 S |
| Smiles: | COc1ccc2c(C=C(CO2)C(NCc2ccc(cc2)SC)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.9403 |
| logD: | 3.9403 |
| logSw: | -4.1803 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.565 |
| InChI Key: | WAPNKNLNHUOCOD-UHFFFAOYSA-N |