(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 |