N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-1H-pyrrole-2-carboxamide
N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | S554-0892 |
| Compound Name: | N-{[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 346.39 |
| Molecular Formula: | C19 H18 N6 O |
| Smiles: | Cc1ccc(cc1C)c1ccc2nnc(CNC(c3ccc[nH]3)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7675 |
| logD: | 2.7675 |
| logSw: | -2.9827 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.853 |
| InChI Key: | RTVQKYOJMZTNIZ-UHFFFAOYSA-N |