3-chloro-N-{[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
3-chloro-N-{[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | S554-0245 |
| Compound Name: | 3-chloro-N-{[6-(4-chlorophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}benzamide |
| Molecular Weight: | 398.25 |
| Molecular Formula: | C19 H13 Cl2 N5 O |
| Smiles: | C(c1nnc2ccc(c3ccc(cc3)[Cl])nn12)NC(c1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8887 |
| logD: | 3.8885 |
| logSw: | -4.5066 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.787 |
| InChI Key: | VEFDNLKXYNYDNL-UHFFFAOYSA-N |