N-[2-({[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}amino)-2-oxoethyl]benzamide
Chemical Structure Depiction of
N-[2-({[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}amino)-2-oxoethyl]benzamide
N-[2-({[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}amino)-2-oxoethyl]benzamide
Compound characteristics
| Compound ID: | S554-0581 |
| Compound Name: | N-[2-({[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}amino)-2-oxoethyl]benzamide |
| Molecular Weight: | 400.44 |
| Molecular Formula: | C22 H20 N6 O2 |
| Smiles: | Cc1ccc(cc1)c1ccc2nnc(CNC(CNC(c3ccccc3)=O)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7113 |
| logD: | 2.7113 |
| logSw: | -2.9928 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.258 |
| InChI Key: | NRICGENDSGTWQU-UHFFFAOYSA-N |