N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide
Compound characteristics
| Compound ID: | S823-0975 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-(3,5-dimethyl-1H-pyrazol-4-yl)propanamide |
| Molecular Weight: | 356.47 |
| Molecular Formula: | C20 H28 N4 O2 |
| Smiles: | Cc1c(CCC(N[C@@H]2CN(Cc3ccccc3)C[C@H]2CO)=O)c(C)[nH]n1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2295 |
| logD: | -0.94 |
| logSw: | -1.7562 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 69.357 |
| InChI Key: | GBWCOMGYZYHLDM-MJGOQNOKSA-N |