1-(4-benzylpiperazin-1-yl)-2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(4-benzylpiperazin-1-yl)-2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one
1-(4-benzylpiperazin-1-yl)-2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | P103-1063 |
| Compound Name: | 1-(4-benzylpiperazin-1-yl)-2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C21 H23 N5 O2 S |
| Smiles: | Cc1nc(c2cccnc2SCC(N2CCN(CC2)Cc2ccccc2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.2943 |
| logD: | 2.1659 |
| logSw: | -2.9055 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.984 |
| InChI Key: | MRGLETORIYZIRQ-UHFFFAOYSA-N |