2-(3-chlorophenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
2-(3-chlorophenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S824-1927 |
| Compound Name: | 2-(3-chlorophenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 330.81 |
| Molecular Formula: | C18 H19 Cl N2 O2 |
| Smiles: | C(C(N1C[C@@H](CO)[C@@H](C1)c1ccncc1)=O)c1cccc(c1)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3663 |
| logD: | 2.259 |
| logSw: | -2.8797 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.864 |
| InChI Key: | VLDCKSOMNQEHRR-RDJZCZTQSA-N |