N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(2-methoxybenzoyl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(2-methoxybenzoyl)pyrrolidin-3-yl]benzamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(2-methoxybenzoyl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S823-7622 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(2-methoxybenzoyl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 354.4 |
| Molecular Formula: | C20 H22 N2 O4 |
| Smiles: | COc1ccccc1C(N1C[C@H]([C@@H](C1)CO)NC(c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1196 |
| logD: | 1.1196 |
| logSw: | -2.1171 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.202 |
| InChI Key: | NKIVWYOGNVQBLD-DOTOQJQBSA-N |