3-{[4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazin-1-yl]methyl}benzonitrile
Chemical Structure Depiction of
3-{[4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazin-1-yl]methyl}benzonitrile
3-{[4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazin-1-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | T473-1068 |
| Compound Name: | 3-{[4-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-7-yl)piperazin-1-yl]methyl}benzonitrile |
| Molecular Weight: | 333.39 |
| Molecular Formula: | C18 H19 N7 |
| Smiles: | Cc1nnc2cc(cnn12)N1CCN(CC1)Cc1cccc(C#N)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.6789 |
| logD: | 0.6723 |
| logSw: | -0.8808 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.719 |
| InChI Key: | ACJXCYCAHPIRKJ-UHFFFAOYSA-N |