1-[2-(4-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-[3-(trifluoromethyl)phenyl]ethan-1-one
Chemical Structure Depiction of
1-[2-(4-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-[3-(trifluoromethyl)phenyl]ethan-1-one
1-[2-(4-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-[3-(trifluoromethyl)phenyl]ethan-1-one
Compound characteristics
| Compound ID: | P218-0195 |
| Compound Name: | 1-[2-(4-methylphenyl)-7,8-dihydro-4H-pyrazolo[1,5-a][1,4]diazepin-5(6H)-yl]-2-[3-(trifluoromethyl)phenyl]ethan-1-one |
| Molecular Weight: | 413.44 |
| Molecular Formula: | C23 H22 F3 N3 O |
| Smiles: | Cc1ccc(cc1)c1cc2CN(CCCn2n1)C(Cc1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8404 |
| logD: | 4.8404 |
| logSw: | -4.7342 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.8897 |
| InChI Key: | JGUVXEGRCZBRSI-UHFFFAOYSA-N |