2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[(2-chlorophenyl)methyl]acetamide
Chemical Structure Depiction of
2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[(2-chlorophenyl)methyl]acetamide
2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[(2-chlorophenyl)methyl]acetamide
Compound characteristics
| Compound ID: | M460-3113 |
| Compound Name: | 2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]-N-[(2-chlorophenyl)methyl]acetamide |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C20 H23 Cl N6 O2 |
| Smiles: | C1CCCN(CC1)C1C2=NN(CC(NCc3ccccc3[Cl])=O)C(N2C=CN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.51 |
| logD: | 2.51 |
| logSw: | -3.1021 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.862 |
| InChI Key: | NUGXSJWAFLKDTJ-UHFFFAOYSA-N |