N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1,3-oxazole-4-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | S823-1987 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 301.34 |
| Molecular Formula: | C16 H19 N3 O3 |
| Smiles: | C(c1ccccc1)N1C[C@H]([C@@H](C1)CO)NC(c1cocn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4578 |
| logD: | -1.2353 |
| logSw: | -1.645 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.985 |
| InChI Key: | XSTALSHIPVCVAQ-KGLIPLIRSA-N |