[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3-methylphenyl)methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3-methylphenyl)methanone
[rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3-methylphenyl)methanone
Compound characteristics
| Compound ID: | SB34-1242 |
| Compound Name: | [rel-(3R,4R)-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](3-methylphenyl)methanone |
| Molecular Weight: | 302.35 |
| Molecular Formula: | C16 H19 F N4 O |
| Smiles: | Cc1cccc(c1)C(N1C[C@@H](CF)[C@@H](C1)c1nc(C)n[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3296 |
| logD: | 1.3291 |
| logSw: | -2.2551 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.517 |
| InChI Key: | QZTQZWYEBSAZJL-KBPBESRZSA-N |