N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-phenoxyacetamide
Chemical Structure Depiction of
N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-phenoxyacetamide
N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-phenoxyacetamide
Compound characteristics
| Compound ID: | S554-0879 |
| Compound Name: | N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-2-phenoxyacetamide |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C22 H21 N5 O2 |
| Smiles: | Cc1ccc(cc1C)c1ccc2nnc(CNC(COc3ccccc3)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3567 |
| logD: | 3.3567 |
| logSw: | -3.4907 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.072 |
| InChI Key: | BXEJUCSRQMBWPQ-UHFFFAOYSA-N |