7-ethoxy-5-[4-(methylsulfanyl)phenyl]-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
7-ethoxy-5-[4-(methylsulfanyl)phenyl]-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
7-ethoxy-5-[4-(methylsulfanyl)phenyl]-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | K805-0141 |
| Compound Name: | 7-ethoxy-5-[4-(methylsulfanyl)phenyl]-2-(thiophen-2-yl)-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C23 H22 N2 O2 S2 |
| Smiles: | CCOc1cccc2C3CC(c4cccs4)=NN3C(c3ccc(cc3)SC)Oc12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.2135 |
| logD: | 6.2135 |
| logSw: | -5.8057 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.9586 |
| InChI Key: | RCNGNGKRWOOMEA-UHFFFAOYSA-N |