N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thiophene-3-carbonyl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thiophene-3-carbonyl)pyrrolidin-3-yl]benzamide
N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thiophene-3-carbonyl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S823-7642 |
| Compound Name: | N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(thiophene-3-carbonyl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 330.4 |
| Molecular Formula: | C17 H18 N2 O3 S |
| Smiles: | C1[C@H]([C@@H](CN1C(c1ccsc1)=O)CO)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.0513 |
| logD: | 1.0513 |
| logSw: | -1.9958 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.59 |
| InChI Key: | KIHKWQNJSOENCW-LSDHHAIUSA-N |