N-(3-acetylphenyl)-2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-(3-acetylphenyl)-2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M460-1476 |
| Compound Name: | N-(3-acetylphenyl)-2-[8-(azepan-1-yl)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | CC(c1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)N1CCCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8911 |
| logD: | 1.8911 |
| logSw: | -2.6531 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.367 |
| InChI Key: | BAZYHRVZZGHYAW-UHFFFAOYSA-N |