4-(1,3-benzothiazol-2-yl)-1-{2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-{2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
4-(1,3-benzothiazol-2-yl)-1-{2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S428-1308 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-{2-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 426.54 |
| Molecular Formula: | C22 H26 N4 O3 S |
| Smiles: | C(CC(N1CCCC1c1nc(C2CCOCC2)no1)=O)Cc1nc2ccccc2s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8653 |
| logD: | 3.8653 |
| logSw: | -3.9419 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.141 |
| InChI Key: | TYECWMZKKZKUTF-KRWDZBQOSA-N |