AC1LYNUW structure

AC1LYNUW

12-(4-methoxyphenyl)-16-methylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one

Also Known As: ChemDiv1_024577|HMS656N03|4-(4-methoxyphenyl)-1-(methylthio)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one|4-(4-methoxyphenyl)-1-(methylsulfanyl)-4H-spiro[benzo[h][1,2,4]triazolo[4,3-a]quinazoline-6,1'-cyclohexan]-5(7H)-one

CAS: 373369-48-3
Molecular Formula C26H26N4O2S
Molecular Weight 458.17764 g/mol
LogP 5.0357
Topological Polar Surface Area 61.42 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 458.17764
Monoisotopic Mass 458.17764
Heavy Atoms 33
Complexity 1414.9989

Chemical Identifiers

CAS Number 373369-48-3
SMILES COC1=CC=C(C=C1)N2C(=O)C3=C(C4=CC=CC=C4CC35CCCCC5)N6C2=NN=C6SC

Product Overview

AC1LYNUW (CAS 373369-48-3), with molecular formula C26H26N4O2S and molecular weight 458.17764 g/mol. IUPAC: 12-(4-methoxyphenyl)-16-methylsulfanylspiro[12,14,15,17-tetrazatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,13,15-hexaene-9,1'-cyclohexane]-11-one.

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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.
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