2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-cyanophenyl)acetamide
Chemical Structure Depiction of
2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-cyanophenyl)acetamide
2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-cyanophenyl)acetamide
Compound characteristics
| Compound ID: | M460-1479 |
| Compound Name: | 2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-(4-cyanophenyl)acetamide |
| Molecular Weight: | 391.43 |
| Molecular Formula: | C20 H21 N7 O2 |
| Smiles: | C1CCCN(CC1)C1C2=NN(CC(Nc3ccc(C#N)cc3)=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8047 |
| logD: | 1.8046 |
| logSw: | -2.3519 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.596 |
| InChI Key: | RONCHTXEOMBFCJ-UHFFFAOYSA-N |