(2,5-dimethylphenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2,5-dimethylphenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
(2,5-dimethylphenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S824-2041 |
| Compound Name: | (2,5-dimethylphenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 310.39 |
| Molecular Formula: | C19 H22 N2 O2 |
| Smiles: | Cc1ccc(C)c(c1)C(N1C[C@@H](CO)[C@@H](C1)c1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.3199 |
| logD: | 2.2126 |
| logSw: | -2.7191 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.391 |
| InChI Key: | IYHRYYSPLWBGPV-WMZOPIPTSA-N |