7-(3,4-dimethylphenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(3,4-dimethylphenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(3,4-dimethylphenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0645 |
| Compound Name: | 7-(3,4-dimethylphenyl)-3-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 430.45 |
| Molecular Formula: | C21 H17 F3 N4 O S |
| Smiles: | Cc1ccc(cc1C)N1C=Cn2c(C1=O)nnc2SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.2424 |
| logD: | 4.2424 |
| logSw: | -4.4166 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.702 |
| InChI Key: | UILVCEFPUAAMHC-UHFFFAOYSA-N |