2-(4-ethoxyphenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
2-(4-ethoxyphenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S824-2388 |
| Compound Name: | 2-(4-ethoxyphenyl)-1-[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 340.42 |
| Molecular Formula: | C20 H24 N2 O3 |
| Smiles: | CCOc1ccc(CC(N2C[C@@H](CO)[C@@H](C2)c2ccncc2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0343 |
| logD: | 1.927 |
| logSw: | -2.3042 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.988 |
| InChI Key: | AAMWNMMHXHKDCB-HKUYNNGSSA-N |