7-(3-chloro-2-methylphenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(3-chloro-2-methylphenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(3-chloro-2-methylphenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0807 |
| Compound Name: | 7-(3-chloro-2-methylphenyl)-3-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 428.87 |
| Molecular Formula: | C20 H14 Cl F N4 O2 S |
| Smiles: | Cc1c(cccc1[Cl])N1C=Cn2c(C1=O)nnc2SCC(c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0106 |
| logD: | 3.0106 |
| logSw: | -3.5426 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.648 |
| InChI Key: | AXJITALEPHSWMT-UHFFFAOYSA-N |