N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]isoquinoline-1-carboxamide
Chemical Structure Depiction of
N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]isoquinoline-1-carboxamide
N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]isoquinoline-1-carboxamide
Compound characteristics
| Compound ID: | S554-0056 |
| Compound Name: | N-[(6-phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]isoquinoline-1-carboxamide |
| Molecular Weight: | 380.41 |
| Molecular Formula: | C22 H16 N6 O |
| Smiles: | C(c1nnc2ccc(c3ccccc3)nn12)NC(c1c2ccccc2ccn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6841 |
| logD: | 2.6841 |
| logSw: | -3.0235 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.333 |
| InChI Key: | FSEBCXHFVJUSBA-UHFFFAOYSA-N |