1-[2-(3-methylphenyl)pyrrolidin-1-yl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[2-(3-methylphenyl)pyrrolidin-1-yl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]ethan-1-one
1-[2-(3-methylphenyl)pyrrolidin-1-yl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | D398-0328 |
| Compound Name: | 1-[2-(3-methylphenyl)pyrrolidin-1-yl]-2-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]ethan-1-one |
| Molecular Weight: | 391.44 |
| Molecular Formula: | C21 H24 F3 N3 O |
| Smiles: | Cc1cccc(c1)C1CCCN1C(Cn1c2CCCCc2c(C(F)(F)F)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9601 |
| logD: | 3.9601 |
| logSw: | -3.9796 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.8 |
| InChI Key: | KTPZWMMNVLLCGE-KRWDZBQOSA-N |