rel-(3R,4R)-1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S641-0206 |
| Compound Name: | rel-(3R,4R)-1-{5-[(1H-imidazol-1-yl)methyl]furan-2-carbonyl}-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C17 H19 N7 O3 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2C(N)=O)C(c2ccc(Cn3ccnc3)o2)=O)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.7961 |
| logD: | -0.8189 |
| logSw: | -1.6652 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.968 |
| InChI Key: | VDDGPADDOSORQA-STQMWFEESA-N |