3-(1,3-benzothiazol-2-yl)-1-{3-fluoro-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}propan-1-one
Chemical Structure Depiction of
3-(1,3-benzothiazol-2-yl)-1-{3-fluoro-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}propan-1-one
3-(1,3-benzothiazol-2-yl)-1-{3-fluoro-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | SC39-0121 |
| Compound Name: | 3-(1,3-benzothiazol-2-yl)-1-{3-fluoro-3-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}propan-1-one |
| Molecular Weight: | 430.5 |
| Molecular Formula: | C21 H23 F N4 O3 S |
| Smiles: | C1COCCC1c1nc(C2(CCN(C2)C(CCc2nc3ccccc3s2)=O)F)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.544 |
| logD: | 3.544 |
| logSw: | -3.4446 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.381 |
| InChI Key: | JVIYRVCMTLAQLK-NRFANRHFSA-N |