N-(4-butylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Chemical Structure Depiction of
N-(4-butylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
N-(4-butylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide
Compound characteristics
| Compound ID: | M452-0481 |
| Compound Name: | N-(4-butylphenyl)-2-[6-(3,4-dimethylphenyl)-3-oxo[1,2,4]triazolo[4,3-b]pyridazin-2(3H)-yl]acetamide |
| Molecular Weight: | 429.52 |
| Molecular Formula: | C25 H27 N5 O2 |
| Smiles: | CCCCc1ccc(cc1)NC(CN1C(N2C(C=CC(c3ccc(C)c(C)c3)=N2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3528 |
| logD: | 6.3528 |
| logSw: | -5.359 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.906 |
| InChI Key: | OLZVMMJQCHZERG-UHFFFAOYSA-N |