2-[6-(benzenesulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3-chloro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[6-(benzenesulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3-chloro-4-methylphenyl)acetamide
2-[6-(benzenesulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3-chloro-4-methylphenyl)acetamide
Compound characteristics
Compound ID: | F803-0153 |
Compound Name: | 2-[6-(benzenesulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]-N-(3-chloro-4-methylphenyl)acetamide |
Molecular Weight: | 457.89 |
Molecular Formula: | C20 H16 Cl N5 O4 S |
Smiles: | Cc1ccc(cc1[Cl])NC(CN1C(N2C(C=CC(=N2)S(c2ccccc2)(=O)=O)=N1)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8113 |
logD: | 3.8112 |
logSw: | -4.1788 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 97.462 |
InChI Key: | YZMWBYMCFYOJPW-UHFFFAOYSA-N |