rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)acetyl]pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)acetyl]pyrrolidine-3-carboxamide
rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)acetyl]pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S641-0100 |
| Compound Name: | rel-(3R,4R)-4-(3-methyl-1H-1,2,4-triazol-5-yl)-1-[(pyridin-3-yl)acetyl]pyrrolidine-3-carboxamide |
| Molecular Weight: | 314.34 |
| Molecular Formula: | C15 H18 N6 O2 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2C(N)=O)C(Cc2cccnc2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.1331 |
| logD: | -1.1421 |
| logSw: | -1.3303 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.567 |
| InChI Key: | SHYUHOCVIFLHIP-RYUDHWBXSA-N |