3-fluoro-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-2-carboxamide
Chemical Structure Depiction of
3-fluoro-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-2-carboxamide
3-fluoro-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-2-carboxamide
Compound characteristics
| Compound ID: | SB33-0906 |
| Compound Name: | 3-fluoro-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-2-carboxamide |
| Molecular Weight: | 366.4 |
| Molecular Formula: | C19 H19 F N6 O |
| Smiles: | CN1C[C@H]([C@@H](C1)c1nc(c2ccccc2)n[nH]1)NC(c1c(cccn1)F)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5947 |
| logD: | -0.0123 |
| logSw: | -2.1432 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.808 |
| InChI Key: | KFDQJSJOCHKNGN-ZFWWWQNUSA-N |