2-([1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Chemical Structure Depiction of
2-([1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
2-([1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide
Compound characteristics
| Compound ID: | C734-0666 |
| Compound Name: | 2-([1]benzopyrano[4,3-c]pyrazol-1(4H)-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}acetamide |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C21 H21 N3 O2 S |
| Smiles: | CSc1ccc(CCNC(Cn2c3c(COc4ccccc34)cn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8157 |
| logD: | 2.8157 |
| logSw: | -3.4578 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.22 |
| InChI Key: | PHKGBMJDSRCCQA-UHFFFAOYSA-N |