4-[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-1-methylpiperidine
Chemical Structure Depiction of
4-[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-1-methylpiperidine
4-[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-1-methylpiperidine
Compound characteristics
| Compound ID: | SB34-0431 |
| Compound Name: | 4-[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-1-methylpiperidine |
| Molecular Weight: | 343.45 |
| Molecular Formula: | C19 H26 F N5 |
| Smiles: | CN1CCC(CC1)N1C[C@@H](CF)[C@@H](C1)c1nc(c2ccccc2)n[nH]1 |
| Stereo: | RELATIVE |
| logP: | 2.1136 |
| logD: | -0.1438 |
| logSw: | -2.3207 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.747 |
| InChI Key: | YZLASTCJKOXEFX-RDJZCZTQSA-N |