3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-1071 |
| Compound Name: | 3-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 404.53 |
| Molecular Formula: | C23 H24 N4 O S |
| Smiles: | CC(C)c1ccc(cc1)N1C=Cn2c(C1=O)nnc2SCc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 4.9037 |
| logD: | 4.9037 |
| logSw: | -4.6119 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.702 |
| InChI Key: | FLHOTOKZEHWULN-UHFFFAOYSA-N |