5-methyl-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-3-carboxamide
Chemical Structure Depiction of
5-methyl-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-3-carboxamide
5-methyl-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | SB33-0964 |
| Compound Name: | 5-methyl-N-[rel-(3R,4S)-1-methyl-4-(3-phenyl-1H-1,2,4-triazol-5-yl)pyrrolidin-3-yl]pyridine-3-carboxamide |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C20 H22 N6 O |
| Smiles: | Cc1cc(cnc1)C(N[C@@H]1CN(C)C[C@H]1c1nc(c2ccccc2)n[nH]1)=O |
| Stereo: | RELATIVE |
| logP: | 1.7286 |
| logD: | 0.4466 |
| logSw: | -2.3144 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.597 |
| InChI Key: | JUKDQGQLGCVEIQ-IRXDYDNUSA-N |