4-(1,3-benzothiazol-2-yl)-1-{4-methyl-4-[5-(pyridin-2-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl}butan-1-one
Chemical Structure Depiction of
4-(1,3-benzothiazol-2-yl)-1-{4-methyl-4-[5-(pyridin-2-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl}butan-1-one
4-(1,3-benzothiazol-2-yl)-1-{4-methyl-4-[5-(pyridin-2-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S429-1391 |
| Compound Name: | 4-(1,3-benzothiazol-2-yl)-1-{4-methyl-4-[5-(pyridin-2-yl)-1,2,4-oxadiazol-3-yl]piperidin-1-yl}butan-1-one |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C24 H25 N5 O2 S |
| Smiles: | CC1(CCN(CC1)C(CCCc1nc2ccccc2s1)=O)c1nc(c2ccccn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.9086 |
| logD: | 3.9086 |
| logSw: | -3.9154 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.029 |
| InChI Key: | PBSGYMXHVUMCCC-UHFFFAOYSA-N |