5-[rel-(3R,4R)-1-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(fluoromethyl)pyrrolidin-3-yl]-3-methyl-1H-1,2,4-triazole
Chemical Structure Depiction of
5-[rel-(3R,4R)-1-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(fluoromethyl)pyrrolidin-3-yl]-3-methyl-1H-1,2,4-triazole
5-[rel-(3R,4R)-1-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(fluoromethyl)pyrrolidin-3-yl]-3-methyl-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | SB34-0100 |
| Compound Name: | 5-[rel-(3R,4R)-1-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(fluoromethyl)pyrrolidin-3-yl]-3-methyl-1H-1,2,4-triazole |
| Molecular Weight: | 292.36 |
| Molecular Formula: | C14 H21 F N6 |
| Smiles: | Cc1nc([C@@H]2CN(Cc3cnn(C)c3C)C[C@H]2CF)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.0888 |
| logD: | -5.8663 |
| logSw: | -1.3409 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.088 |
| InChI Key: | RJCBJZNKPBQDSW-AAEUAGOBSA-N |