AC1OH9HW
N-[2-(6-benzylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-4-methylbenzamide
Also Known As: F2007-0197|N-{2-[6-(benzylsulfanyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethyl}-4-methylbenzamide|N-(2-(6-(benzylthio)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl)-4-methylbenzamide|N-[2-(6-benzylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-4-methylbenzamide
CAS: 872995-20-5
| Molecular Formula | C22H21N5OS |
|---|---|
| Molecular Weight | 403.14667 g/mol |
| LogP | 3.69752 |
| Topological Polar Surface Area | 72.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 403.14667 |
| Monoisotopic Mass | 403.14667 |
| Heavy Atoms | 29 |
| Complexity | 1109.2278 |
Chemical Identifiers
| CAS Number | 872995-20-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCC2=NN=C3N2N=C(C=C3)SCC4=CC=CC=C4 |
Product Overview
AC1OH9HW (CAS 872995-20-5), with molecular formula C22H21N5OS and molecular weight 403.14667 g/mol. IUPAC: N-[2-(6-benzylsulfanyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethyl]-4-methylbenzamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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