(3,4-difluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(3,4-difluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
(3,4-difluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S824-2662 |
| Compound Name: | (3,4-difluorophenyl)[rel-(3R,4S)-3-(hydroxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 318.32 |
| Molecular Formula: | C17 H16 F2 N2 O2 |
| Smiles: | C1[C@@H](CO)[C@@H](CN1C(c1ccc(c(c1)F)F)=O)c1ccncc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.6323 |
| logD: | 1.5249 |
| logSw: | -2.0656 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.391 |
| InChI Key: | URYMIDQVIUKPEM-KBPBESRZSA-N |