N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methyl-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methyl-1,3-oxazole-4-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methyl-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | S823-1981 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methyl-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 315.37 |
| Molecular Formula: | C17 H21 N3 O3 |
| Smiles: | Cc1nc(co1)C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7982 |
| logD: | -0.8948 |
| logSw: | -1.6077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.624 |
| InChI Key: | XVCQGXCTOMHZIC-LSDHHAIUSA-N |