3-{[(3-methoxyphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
3-{[(3-methoxyphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
3-{[(3-methoxyphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-1075 |
| Compound Name: | 3-{[(3-methoxyphenyl)methyl]sulfanyl}-7-[4-(propan-2-yl)phenyl][1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 406.51 |
| Molecular Formula: | C22 H22 N4 O2 S |
| Smiles: | CC(C)c1ccc(cc1)N1C=Cn2c(C1=O)nnc2SCc1cccc(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7315 |
| logD: | 3.7315 |
| logSw: | -4.0165 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.246 |
| InChI Key: | KRJJISZWBPVQKC-UHFFFAOYSA-N |