2-{5-[rel-(3R,4S)-1-(butane-1-sulfonyl)-4-(pyridin-3-yl)pyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyrazine
Chemical Structure Depiction of
2-{5-[rel-(3R,4S)-1-(butane-1-sulfonyl)-4-(pyridin-3-yl)pyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyrazine
2-{5-[rel-(3R,4S)-1-(butane-1-sulfonyl)-4-(pyridin-3-yl)pyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyrazine
Compound characteristics
| Compound ID: | SB56-0782 |
| Compound Name: | 2-{5-[rel-(3R,4S)-1-(butane-1-sulfonyl)-4-(pyridin-3-yl)pyrrolidin-3-yl]-1,2,4-oxadiazol-3-yl}pyrazine |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C19 H22 N6 O3 S |
| Smiles: | CCCCS(N1C[C@@H](c2nc(c3cnccn3)no2)[C@@H](C1)c1cccnc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.873 |
| logD: | 1.8713 |
| logSw: | -2.3313 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 91.566 |
| InChI Key: | NMWCMEVENWQZBZ-JKSUJKDBSA-N |