N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-methylthiophene-2-carboxamide
Chemical Structure Depiction of
N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-methylthiophene-2-carboxamide
N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-methylthiophene-2-carboxamide
Compound characteristics
| Compound ID: | S554-0682 |
| Compound Name: | N-{[6-(4-methoxyphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-3-methylthiophene-2-carboxamide |
| Molecular Weight: | 379.44 |
| Molecular Formula: | C19 H17 N5 O2 S |
| Smiles: | Cc1ccsc1C(NCc1nnc2ccc(c3ccc(cc3)OC)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9441 |
| logD: | 2.9441 |
| logSw: | -3.2816 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.349 |
| InChI Key: | FZXBENCSWLVHCD-UHFFFAOYSA-N |