N-(3-acetylphenyl)-2-{[6-(4-bromophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-2-{[6-(4-bromophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
N-(3-acetylphenyl)-2-{[6-(4-bromophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G856-6477 |
| Compound Name: | N-(3-acetylphenyl)-2-{[6-(4-bromophenyl)[1,2,4]triazolo[4,3-b]pyridazin-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 482.36 |
| Molecular Formula: | C21 H16 Br N5 O2 S |
| Smiles: | CC(c1cccc(c1)NC(CSc1nnc2ccc(c3ccc(cc3)[Br])nn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1638 |
| logD: | 4.1637 |
| logSw: | -4.2338 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.683 |
| InChI Key: | YKFIYUYSKBVIDX-UHFFFAOYSA-N |