4-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidine-1-carbonyl}benzonitrile
Chemical Structure Depiction of
4-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidine-1-carbonyl}benzonitrile
4-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidine-1-carbonyl}benzonitrile
Compound characteristics
| Compound ID: | SA24-1275 |
| Compound Name: | 4-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidine-1-carbonyl}benzonitrile |
| Molecular Weight: | 321.32 |
| Molecular Formula: | C16 H17 F2 N3 O2 |
| Smiles: | C1[C@@H](CO)N(CC1(F)F)C1CN(C1)C(c1ccc(C#N)cc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.7915 |
| logD: | 0.7908 |
| logSw: | -1.402 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.295 |
| InChI Key: | DUXDZODFKJKWTE-CYBMUJFWSA-N |