rel-(3R,4R)-N-methyl-1-(1-methyl-1H-imidazole-2-carbonyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-N-methyl-1-(1-methyl-1H-imidazole-2-carbonyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
rel-(3R,4R)-N-methyl-1-(1-methyl-1H-imidazole-2-carbonyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S641-0703 |
| Compound Name: | rel-(3R,4R)-N-methyl-1-(1-methyl-1H-imidazole-2-carbonyl)-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 317.35 |
| Molecular Formula: | C14 H19 N7 O2 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2C(NC)=O)C(c2nccn2C)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.5511 |
| logD: | -1.5516 |
| logSw: | -1.643 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.69 |
| InChI Key: | GHNXLTXRIAFQPE-NXEZZACHSA-N |