(5-chloro-2-fluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(5-chloro-2-fluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
(5-chloro-2-fluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S824-2530 |
| Compound Name: | (5-chloro-2-fluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 334.78 |
| Molecular Formula: | C17 H16 Cl F N2 O2 |
| Smiles: | C1[C@@H](CO)[C@@H](CN1C(c1cc(ccc1F)[Cl])=O)c1ccncc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.27 |
| logD: | 2.1627 |
| logSw: | -3.0174 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.391 |
| InChI Key: | POVLUVPYLVGYAH-WFASDCNBSA-N |