rel-(3R,4R)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-(phenoxymethyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-(phenoxymethyl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-(phenoxymethyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-0649 |
| Compound Name: | rel-(3R,4R)-1-(1,3-dimethyl-1H-pyrazole-4-carbonyl)-4-(phenoxymethyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | Cc1c(cn(C)n1)C(N1C[C@@H](COc2ccccc2)[C@@H](C1)C(N)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4894 |
| logD: | 0.4894 |
| logSw: | -2.2394 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.568 |
| InChI Key: | NAUHNNHCSSFFBV-XJKSGUPXSA-N |