(2,4-dimethylphenyl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2,4-dimethylphenyl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone
(2,4-dimethylphenyl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S831-2637 |
| Compound Name: | (2,4-dimethylphenyl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(pyridin-2-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 310.39 |
| Molecular Formula: | C19 H22 N2 O2 |
| Smiles: | Cc1ccc(C(N2C[C@@H](CO)[C@@H](C2)c2ccccn2)=O)c(C)c1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.2227 |
| logD: | 2.2227 |
| logSw: | -2.9205 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.011 |
| InChI Key: | QKBCUBNJPYDPEL-DOTOQJQBSA-N |