2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol
Chemical Structure Depiction of
2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol
2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol
Compound characteristics
| Compound ID: | 7896-0003 |
| Compound Name: | 2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol |
| Molecular Weight: | 340.44 |
| Molecular Formula: | C19 H20 N2 O2 S |
| Smiles: | CSCCC1N2C(CC(c3ccccc3O)=N2)c2ccccc2O1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7971 |
| logD: | 4.7935 |
| logSw: | -4.0675 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.06 |
| InChI Key: | FRPBVKHZXZXUAP-UHFFFAOYSA-N |