7-(4-bromophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Chemical Structure Depiction of
7-(4-bromophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
7-(4-bromophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one
Compound characteristics
| Compound ID: | G802-0986 |
| Compound Name: | 7-(4-bromophenyl)-3-{[1-(3,4-dimethylphenyl)-1-oxopropan-2-yl]sulfanyl}[1,2,4]triazolo[4,3-a]pyrazin-8(7H)-one |
| Molecular Weight: | 483.39 |
| Molecular Formula: | C22 H19 Br N4 O2 S |
| Smiles: | CC(C(c1ccc(C)c(C)c1)=O)Sc1nnc2C(N(C=Cn12)c1ccc(cc1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4014 |
| logD: | 4.4014 |
| logSw: | -4.3067 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.441 |
| InChI Key: | ZAOBAKBVMJCGCC-HNNXBMFYSA-N |