N-(3-acetylphenyl)-2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
N-(3-acetylphenyl)-2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M446-2075 |
| Compound Name: | N-(3-acetylphenyl)-2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamide |
| Molecular Weight: | 431.45 |
| Molecular Formula: | C23 H21 N5 O4 |
| Smiles: | CC(c1cccc(c1)NC(CN1C(N2C=CN=C(C2=N1)Oc1cc(C)cc(C)c1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7149 |
| logD: | 2.7148 |
| logSw: | -3.0467 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.041 |
| InChI Key: | CDLUASAOLOYKFQ-UHFFFAOYSA-N |