1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3-methylphenyl)ethan-1-one
1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | S827-2959 |
| Compound Name: | 1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}-2-(3-methylphenyl)ethan-1-one |
| Molecular Weight: | 351.35 |
| Molecular Formula: | C17 H19 F2 N3 O3 |
| Smiles: | Cc1cccc(CC(N2CC(C[C@H]2c2nc(COC)no2)(F)F)=O)c1 |
| Stereo: | ABSOLUTE |
| logP: | 2.963 |
| logD: | 2.963 |
| logSw: | -2.9849 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.444 |
| InChI Key: | IRFGAECVYPCBHV-CYBMUJFWSA-N |