[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](pyrimidin-5-yl)methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](pyrimidin-5-yl)methanone
[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](pyrimidin-5-yl)methanone
Compound characteristics
| Compound ID: | SB34-0485 |
| Compound Name: | [rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](pyrimidin-5-yl)methanone |
| Molecular Weight: | 352.37 |
| Molecular Formula: | C18 H17 F N6 O |
| Smiles: | C1[C@@H](CF)[C@@H](CN1C(c1cncnc1)=O)c1nc(c2ccccc2)n[nH]1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.785 |
| logD: | 0.7806 |
| logSw: | -1.5227 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.383 |
| InChI Key: | QEIBEIWGBNPQOY-ZFWWWQNUSA-N |