N-(3,4-dimethylphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
N-(3,4-dimethylphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | C201-1306 |
| Compound Name: | N-(3,4-dimethylphenyl)-2-[6-(2-methylpropane-2-sulfonyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide |
| Molecular Weight: | 417.49 |
| Molecular Formula: | C19 H23 N5 O4 S |
| Smiles: | Cc1ccc(cc1C)NC(CN1C(N2C(C=CC(=N2)S(C(C)(C)C)(=O)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0464 |
| logD: | 3.0464 |
| logSw: | -3.3017 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.733 |
| InChI Key: | BLCGCMNCDBOSNH-UHFFFAOYSA-N |