4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3,5-dimethylphenyl)butanamide
Chemical Structure Depiction of
4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3,5-dimethylphenyl)butanamide
4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3,5-dimethylphenyl)butanamide
Compound characteristics
| Compound ID: | G423-0129 |
| Compound Name: | 4-[7-(4-chlorophenyl)-8-oxo-7,8-dihydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]-N-(3,5-dimethylphenyl)butanamide |
| Molecular Weight: | 435.91 |
| Molecular Formula: | C23 H22 Cl N5 O2 |
| Smiles: | Cc1cc(C)cc(c1)NC(CCCc1nnc2C(N(C=Cn12)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4961 |
| logD: | 2.4961 |
| logSw: | -3.4053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.246 |
| InChI Key: | SOKFSYVVJVMQMJ-UHFFFAOYSA-N |