1-{4-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one
Chemical Structure Depiction of
1-{4-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one
1-{4-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | S829-1544 |
| Compound Name: | 1-{4-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]piperidin-1-yl}-2-(pyridin-3-yl)ethan-1-one |
| Molecular Weight: | 339.38 |
| Molecular Formula: | C17 H23 F2 N3 O2 |
| Smiles: | C1CN(CCC1N1CC(C[C@H]1CO)(F)F)C(Cc1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.9314 |
| logD: | 0.8131 |
| logSw: | -0.6887 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.031 |
| InChI Key: | NVFHQPUIMFZHOF-OAHLLOKOSA-N |