5-methyl-2-(1-{[3-(trifluoromethyl)phenyl]acetyl}piperidin-4-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Chemical Structure Depiction of
5-methyl-2-(1-{[3-(trifluoromethyl)phenyl]acetyl}piperidin-4-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
5-methyl-2-(1-{[3-(trifluoromethyl)phenyl]acetyl}piperidin-4-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one
Compound characteristics
| Compound ID: | P222-0197 |
| Compound Name: | 5-methyl-2-(1-{[3-(trifluoromethyl)phenyl]acetyl}piperidin-4-yl)-5,6,7,8-tetrahydro-4H-pyrazolo[1,5-a][1,4]diazepin-4-one |
| Molecular Weight: | 434.46 |
| Molecular Formula: | C22 H25 F3 N4 O2 |
| Smiles: | CN1CCCn2c(cc(C3CCN(CC3)C(Cc3cccc(c3)C(F)(F)F)=O)n2)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.2095 |
| logD: | 2.2095 |
| logSw: | -2.5024 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.218 |
| InChI Key: | WUHAEXLFHFOOIV-UHFFFAOYSA-N |