4-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide
Chemical Structure Depiction of
4-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide
4-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide
Compound characteristics
| Compound ID: | S823-2411 |
| Compound Name: | 4-fluoro-N-[rel-(3R,4S)-4-(hydroxymethyl)-1-(oxan-4-yl)pyrrolidin-3-yl]benzamide |
| Molecular Weight: | 322.38 |
| Molecular Formula: | C17 H23 F N2 O3 |
| Smiles: | C1COCCC1N1C[C@H]([C@@H](C1)CO)NC(c1ccc(cc1)F)=O |
| Stereo: | RELATIVE |
| logP: | 0.7059 |
| logD: | -1.9043 |
| logSw: | -1.6292 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.117 |
| InChI Key: | XWLVRUPVJFKVTE-CJNGLKHVSA-N |