4-methyl-2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol
Chemical Structure Depiction of
4-methyl-2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol
4-methyl-2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol
Compound characteristics
| Compound ID: | 7896-0249 |
| Compound Name: | 4-methyl-2-{5-[2-(methylsulfanyl)ethyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenol |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | Cc1ccc(c(c1)C1CC2c3ccccc3OC(CCSC)N2N=1)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2056 |
| logD: | 5.2042 |
| logSw: | -4.8622 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.06 |
| InChI Key: | GFNPBRGFHFYWIH-UHFFFAOYSA-N |