rel-(3R,4R)-3-(fluoromethyl)-N-(3-methoxypropyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-3-(fluoromethyl)-N-(3-methoxypropyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
rel-(3R,4R)-3-(fluoromethyl)-N-(3-methoxypropyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB34-0492 |
| Compound Name: | rel-(3R,4R)-3-(fluoromethyl)-N-(3-methoxypropyl)-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 361.42 |
| Molecular Formula: | C18 H24 F N5 O2 |
| Smiles: | COCCCNC(N1C[C@@H](CF)[C@@H](C1)c1nc(c2ccccc2)n[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.1177 |
| logD: | 2.1133 |
| logSw: | -2.7164 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.231 |
| InChI Key: | OPRPALOEMGYMOG-GJZGRUSLSA-N |