N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-2,4-dimethoxybenzamide
Chemical Structure Depiction of
N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-2,4-dimethoxybenzamide
N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-2,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | SC45-0932 |
| Compound Name: | N-[(5-benzyl-6-oxo-4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazin-3-yl)methyl]-2,4-dimethoxybenzamide |
| Molecular Weight: | 421.45 |
| Molecular Formula: | C22 H23 N5 O4 |
| Smiles: | COc1ccc(C(NCc2c3CN(Cc4ccccc4)C(Cn3nn2)=O)=O)c(c1)OC |
| Stereo: | ACHIRAL |
| logP: | 1.4948 |
| logD: | 1.4948 |
| logSw: | -2.4752 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.4 |
| InChI Key: | GQQSXRAYLCJHNS-UHFFFAOYSA-N |