[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
Chemical Structure Depiction of
[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
[rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone
Compound characteristics
| Compound ID: | SB34-0405 |
| Compound Name: | [rel-(3R,4R)-3-(fluoromethyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl](thiophen-3-yl)methanone |
| Molecular Weight: | 356.42 |
| Molecular Formula: | C18 H17 F N4 O S |
| Smiles: | C1[C@@H](CF)[C@@H](CN1C(c1ccsc1)=O)c1nc(c2ccccc2)n[nH]1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.7241 |
| logD: | 2.7198 |
| logSw: | -3.1037 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.651 |
| InChI Key: | PXGSYGQDRQYFGL-HUUCEWRRSA-N |