1-methyl-N-[3-(methylsulfanyl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-N-[3-(methylsulfanyl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
1-methyl-N-[3-(methylsulfanyl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-1278 |
| Compound Name: | 1-methyl-N-[3-(methylsulfanyl)phenyl]-1,4-dihydro[1]benzopyrano[4,3-c]pyrazole-3-carboxamide |
| Molecular Weight: | 351.43 |
| Molecular Formula: | C19 H17 N3 O2 S |
| Smiles: | Cn1c2c3ccccc3OCc2c(C(Nc2cccc(c2)SC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3515 |
| logD: | 3.3514 |
| logSw: | -3.9158 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.102 |
| InChI Key: | WZDVUJWJZHWSPQ-UHFFFAOYSA-N |