2-(2-chloro-6-fluorophenyl)-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide
Chemical Structure Depiction of
2-(2-chloro-6-fluorophenyl)-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide
2-(2-chloro-6-fluorophenyl)-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide
Compound characteristics
| Compound ID: | S554-0651 |
| Compound Name: | 2-(2-chloro-6-fluorophenyl)-N-{[6-(4-methylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methyl}acetamide |
| Molecular Weight: | 409.85 |
| Molecular Formula: | C21 H17 Cl F N5 O |
| Smiles: | Cc1ccc(cc1)c1ccc2nnc(CNC(Cc3c(cccc3[Cl])F)=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7474 |
| logD: | 3.7474 |
| logSw: | -4.2074 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.573 |
| InChI Key: | UPCMBDJFOPMPME-UHFFFAOYSA-N |