(2,5-difluorophenyl)[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2,5-difluorophenyl)[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methanone
(2,5-difluorophenyl)[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | SB34-0438 |
| Compound Name: | (2,5-difluorophenyl)[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 386.37 |
| Molecular Formula: | C20 H17 F3 N4 O |
| Smiles: | C1[C@@H](CF)[C@@H](CN1C(c1cc(ccc1F)F)=O)c1nc(c2ccccc2)n[nH]1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.3844 |
| logD: | 3.38 |
| logSw: | -3.7031 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.633 |
| InChI Key: | LKIPXIDHUQCLJQ-CZUORRHYSA-N |