2-[8-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide
Chemical Structure Depiction of
2-[8-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide
2-[8-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide
Compound characteristics
| Compound ID: | M460-1972 |
| Compound Name: | 2-[8-(3,4-dihydroisoquinolin-2(1H)-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(3-ethylphenyl)acetamide |
| Molecular Weight: | 428.49 |
| Molecular Formula: | C24 H24 N6 O2 |
| Smiles: | CCc1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)N1CCc2ccccc2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2878 |
| logD: | 3.2878 |
| logSw: | -3.3638 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.871 |
| InChI Key: | XQEDWUOPBWVSQB-UHFFFAOYSA-N |