(2-{4-[(pyridin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl)[3-(trifluoromethoxy)phenyl]methanone
Chemical Structure Depiction of
(2-{4-[(pyridin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl)[3-(trifluoromethoxy)phenyl]methanone
(2-{4-[(pyridin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl)[3-(trifluoromethoxy)phenyl]methanone
Compound characteristics
| Compound ID: | CM2843-7779 |
| Compound Name: | (2-{4-[(pyridin-4-yl)methyl]-4H-1,2,4-triazol-3-yl}pyrrolidin-1-yl)[3-(trifluoromethoxy)phenyl]methanone |
| Molecular Weight: | 417.39 |
| Molecular Formula: | C20 H18 F3 N5 O2 |
| Smiles: | C1CC(c2nncn2Cc2ccncc2)N(C1)C(c1cccc(c1)OC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0986 |
| logD: | 2.0985 |
| logSw: | -2.3912 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.396 |
| InChI Key: | GKTOYPHXLZSNFS-KRWDZBQOSA-N |