2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}-1-[4-(4-methylphenyl)piperazin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}-1-[4-(4-methylphenyl)piperazin-1-yl]ethan-1-one
2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}-1-[4-(4-methylphenyl)piperazin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | P103-0165 |
| Compound Name: | 2-{[3-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-yl]sulfanyl}-1-[4-(4-methylphenyl)piperazin-1-yl]ethan-1-one |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C21 H23 N5 O2 S |
| Smiles: | Cc1ccc(cc1)N1CCN(CC1)C(CSc1c(cccn1)c1nc(C)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1582 |
| logD: | 3.0298 |
| logSw: | -3.3634 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.704 |
| InChI Key: | COCLJNSTSHDEPG-UHFFFAOYSA-N |