[rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](1-ethyl-1H-pyrazol-3-yl)methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](1-ethyl-1H-pyrazol-3-yl)methanone
[rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](1-ethyl-1H-pyrazol-3-yl)methanone
Compound characteristics
| Compound ID: | SB34-0140 |
| Compound Name: | [rel-(3R,4R)-3-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)-4-(fluoromethyl)pyrrolidin-1-yl](1-ethyl-1H-pyrazol-3-yl)methanone |
| Molecular Weight: | 332.38 |
| Molecular Formula: | C16 H21 F N6 O |
| Smiles: | CCn1ccc(C(N2C[C@@H](CF)[C@@H](C2)c2nc(C3CC3)n[nH]2)=O)n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9484 |
| logD: | 0.9466 |
| logSw: | -2.177 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.541 |
| InChI Key: | PPSSNYGUFRHQPV-RYUDHWBXSA-N |