1-(4-benzylpiperazin-1-yl)-2-{[3-(5-ethyl-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-ethyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one
1-(4-benzylpiperazin-1-yl)-2-{[3-(5-ethyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | P103-1327 |
| Compound Name: | 1-(4-benzylpiperazin-1-yl)-2-{[3-(5-ethyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 423.54 |
| Molecular Formula: | C22 H25 N5 O2 S |
| Smiles: | CCc1nc(c2cccnc2SCC(N2CCN(CC2)Cc2ccccc2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.9452 |
| logD: | 2.8168 |
| logSw: | -3.2885 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.422 |
| InChI Key: | YHUDOPADKSGMRX-UHFFFAOYSA-N |