1-[(2S)-4,4-difluoro-2-{[(pyridin-3-yl)oxy]methyl}pyrrolidin-1-yl]-2-(1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[(2S)-4,4-difluoro-2-{[(pyridin-3-yl)oxy]methyl}pyrrolidin-1-yl]-2-(1H-pyrazol-1-yl)ethan-1-one
1-[(2S)-4,4-difluoro-2-{[(pyridin-3-yl)oxy]methyl}pyrrolidin-1-yl]-2-(1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | CM4579-5850 |
| Compound Name: | 1-[(2S)-4,4-difluoro-2-{[(pyridin-3-yl)oxy]methyl}pyrrolidin-1-yl]-2-(1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 322.31 |
| Molecular Formula: | C15 H16 F2 N4 O2 |
| Smiles: | C1[C@@H](COc2cccnc2)N(CC1(F)F)C(Cn1cccn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.6806 |
| logD: | 0.673 |
| logSw: | -0.7656 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.845 |
| InChI Key: | YBPYLEYCSQHYPK-GFCCVEGCSA-N |