1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S831-2621 |
| Compound Name: | 1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethan-1-one |
| Molecular Weight: | 326.39 |
| Molecular Formula: | C19 H22 N2 O3 |
| Smiles: | COc1ccc(CC(N2C[C@@H](CO)[C@@H](C2)c2ccccn2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.5059 |
| logD: | 1.5052 |
| logSw: | -1.9632 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.027 |
| InChI Key: | ZSPWAAHZITVHSU-DOTOQJQBSA-N |