7-ethoxy-2-(4-ethoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
7-ethoxy-2-(4-ethoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
7-ethoxy-2-(4-ethoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
| Compound ID: | K805-0105 |
| Compound Name: | 7-ethoxy-2-(4-ethoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
| Molecular Weight: | 460.59 |
| Molecular Formula: | C27 H28 N2 O3 S |
| Smiles: | CCOc1ccc(cc1)C1CC2c3cccc(c3OC(c3ccc(cc3)SC)N2N=1)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7456 |
| logD: | 6.7456 |
| logSw: | -5.9696 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.064 |
| InChI Key: | QIVYFRQHMUNRRE-UHFFFAOYSA-N |