N-[rel-(3R,4S)-1-[(3-fluorophenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3-fluorophenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]benzamide
N-[rel-(3R,4S)-1-[(3-fluorophenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S823-7626 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3-fluorophenyl)acetyl]-4-(hydroxymethyl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 356.4 |
| Molecular Formula: | C20 H21 F N2 O3 |
| Smiles: | C(C(N1C[C@H]([C@@H](C1)CO)NC(c1ccccc1)=O)=O)c1cccc(c1)F |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.7299 |
| logD: | 1.7299 |
| logSw: | -2.0865 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.044 |
| InChI Key: | ZRQQTOWTUCFUJG-AEFFLSMTSA-N |