2-[9-(4-butoxyphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-chlorophenyl)acetamide
Chemical Structure Depiction of
2-[9-(4-butoxyphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-chlorophenyl)acetamide
2-[9-(4-butoxyphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-chlorophenyl)acetamide
Compound characteristics
Compound ID: | F833-1120 |
Compound Name: | 2-[9-(4-butoxyphenyl)-3-oxopyrazolo[1,5-a][1,2,4]triazolo[3,4-c]pyrazin-2(3H)-yl]-N-(3-chlorophenyl)acetamide |
Molecular Weight: | 490.95 |
Molecular Formula: | C25 H23 Cl N6 O3 |
Smiles: | CCCCOc1ccc(cc1)c1cc2C3=NN(CC(Nc4cccc(c4)[Cl])=O)C(N3C=Cn2n1)=O |
Stereo: | ACHIRAL |
logP: | 4.964 |
logD: | 4.9639 |
logSw: | -5.0151 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 73.886 |
InChI Key: | FMSNTYBSLRPJCN-UHFFFAOYSA-N |