[3-(2-chlorophenyl)-1H-pyrazol-5-yl][rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
[3-(2-chlorophenyl)-1H-pyrazol-5-yl][rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl]methanone
[3-(2-chlorophenyl)-1H-pyrazol-5-yl][rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | SB34-0150 |
| Compound Name: | [3-(2-chlorophenyl)-1H-pyrazol-5-yl][rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 414.87 |
| Molecular Formula: | C20 H20 Cl F N6 O |
| Smiles: | C1CC1c1nc([C@@H]2CN(C[C@H]2CF)C(c2cc(c3ccccc3[Cl])n[nH]2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2283 |
| logD: | 3.2265 |
| logSw: | -3.773 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.646 |
| InChI Key: | BLIQGDXQYTUPQY-TZMCWYRMSA-N |