rel-(3R,4R)-N-ethyl-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-N-ethyl-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
rel-(3R,4R)-N-ethyl-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | SB34-0076 |
| Compound Name: | rel-(3R,4R)-N-ethyl-3-(fluoromethyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 255.29 |
| Molecular Formula: | C11 H18 F N5 O |
| Smiles: | CCNC(N1C[C@@H](CF)[C@@H](C1)c1nc(C)n[nH]1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.0743 |
| logD: | 0.0737 |
| logSw: | -1.6107 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.558 |
| InChI Key: | YRFSKIOIPZCTSR-IUCAKERBSA-N |