2-(azepan-1-yl)-1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
2-(azepan-1-yl)-1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S827-3070 |
| Compound Name: | 2-(azepan-1-yl)-1-{(2S)-4,4-difluoro-2-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 358.39 |
| Molecular Formula: | C16 H24 F2 N4 O3 |
| Smiles: | COCc1nc([C@@H]2CC(CN2C(CN2CCCCCC2)=O)(F)F)on1 |
| Stereo: | ABSOLUTE |
| logP: | 1.6362 |
| logD: | 1.5531 |
| logSw: | -1.6572 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.78 |
| InChI Key: | JQPLPMOGYZGPQS-GFCCVEGCSA-N |