1-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidin-1-yl}-2-(3-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidin-1-yl}-2-(3-methylphenyl)ethan-1-one
1-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidin-1-yl}-2-(3-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SA24-1160 |
| Compound Name: | 1-{3-[(2S)-4,4-difluoro-2-(hydroxymethyl)pyrrolidin-1-yl]azetidin-1-yl}-2-(3-methylphenyl)ethan-1-one |
| Molecular Weight: | 324.37 |
| Molecular Formula: | C17 H22 F2 N2 O2 |
| Smiles: | Cc1cccc(CC(N2CC(C2)N2CC(C[C@H]2CO)(F)F)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 2.1399 |
| logD: | 2.1386 |
| logSw: | -2.4822 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.711 |
| InChI Key: | CQBBNNDQLJGCQJ-CQSZACIVSA-N |