7-ethoxy-2-(3-methoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Chemical Structure Depiction of
7-ethoxy-2-(3-methoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
7-ethoxy-2-(3-methoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine
Compound characteristics
Compound ID: | K805-0087 |
Compound Name: | 7-ethoxy-2-(3-methoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazine |
Molecular Weight: | 446.57 |
Molecular Formula: | C26 H26 N2 O3 S |
Smiles: | CCOc1cccc2C3CC(c4cccc(c4)OC)=NN3C(c3ccc(cc3)SC)Oc12 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 6.413 |
logD: | 6.4129 |
logSw: | -5.8902 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 36.484 |
InChI Key: | FIGHEMPIEHXWQQ-UHFFFAOYSA-N |