2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | M451-0867 |
| Compound Name: | 2-{2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C25 H26 N6 O3 S |
| Smiles: | Cc1cccc(c1)SC1C2=NN(CC(N3CCN(CC3)c3ccccc3OC)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6251 |
| logD: | 2.6248 |
| logSw: | -2.9764 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.419 |
| InChI Key: | BVVCTAWAXRKPSR-UHFFFAOYSA-N |