N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-methylfuran-2-carboxamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-methylfuran-2-carboxamide
N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-methylfuran-2-carboxamide
Compound characteristics
| Compound ID: | S823-1928 |
| Compound Name: | N-[rel-(3R,4S)-1-benzyl-4-(hydroxymethyl)pyrrolidin-3-yl]-3-methylfuran-2-carboxamide |
| Molecular Weight: | 314.38 |
| Molecular Formula: | C18 H22 N2 O3 |
| Smiles: | Cc1ccoc1C(N[C@@H]1CN(Cc2ccccc2)C[C@H]1CO)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7311 |
| logD: | 0.0539 |
| logSw: | -1.9338 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.467 |
| InChI Key: | SHAAVQBVGMTBHR-CVEARBPZSA-N |