1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propan-1-one
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propan-1-one
Compound characteristics
| Compound ID: | M454-0325 |
| Compound Name: | 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-[6-(3,4-dimethylphenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]propan-1-one |
| Molecular Weight: | 489.02 |
| Molecular Formula: | C27 H29 Cl N6 O |
| Smiles: | Cc1ccc(cc1C)c1ccc2nnc(CCC(N3CCN(CC3)c3cc(ccc3C)[Cl])=O)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.9665 |
| logD: | 4.9665 |
| logSw: | -5.0239 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.453 |
| InChI Key: | RAWOAKHVUCJSNS-UHFFFAOYSA-N |