methyl 4-{2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
					Chemical Structure Depiction of
methyl 4-{2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
			methyl 4-{2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | M446-2083 | 
| Compound Name: | methyl 4-{2-[8-(3,5-dimethylphenoxy)-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl]acetamido}benzoate | 
| Molecular Weight: | 447.45 | 
| Molecular Formula: | C23 H21 N5 O5 | 
| Smiles: | Cc1cc(C)cc(c1)OC1C2=NN(CC(Nc3ccc(cc3)C(=O)OC)=O)C(N2C=CN=1)=O | 
| Stereo: | ACHIRAL | 
| logP: | 3.0647 | 
| logD: | 3.0647 | 
| logSw: | -3.3766 | 
| Hydrogen bond acceptors count: | 10 | 
| Hydrogen bond donors count: | 1 | 
| Polar surface area: | 91.388 | 
| InChI Key: | FVLNQHNZADLYFK-UHFFFAOYSA-N | 
 
				 
				