[rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](5-fluoropyridin-2-yl)methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](5-fluoropyridin-2-yl)methanone
[rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](5-fluoropyridin-2-yl)methanone
Compound characteristics
| Compound ID: | SB34-0197 |
| Compound Name: | [rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](5-fluoropyridin-2-yl)methanone |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C16 H17 F2 N5 O |
| Smiles: | C1CC1c1nc([C@@H]2CN(C[C@H]2CF)C(c2ccc(cn2)F)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6711 |
| logD: | 1.6693 |
| logSw: | -2.2188 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.293 |
| InChI Key: | NVHJLBUGKBLMKR-ZYHUDNBSSA-N |