rel-(3R,4R)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-N-methyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-N-methyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-N-methyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S641-4532 |
| Compound Name: | rel-(3R,4R)-1-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-N-methyl-4-(3-methyl-1H-1,2,4-triazol-5-yl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C17 H24 N6 O3 |
| Smiles: | Cc1c(CCC(N2C[C@@H](C(NC)=O)[C@@H](C2)c2nc(C)n[nH]2)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.4474 |
| logD: | -0.4479 |
| logSw: | -1.4224 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.863 |
| InChI Key: | KYWASIFZFGJRDG-KBPBESRZSA-N |