AC1MLW9G structure

AC1MLW9G

N-[[4-(4-fluorophenyl)-5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide

Also Known As: Oprea1_334833|AB00667990-01|F0508-3731|2-{[4-(4-fluorophenyl)-5-{[2-(4-methoxyphenyl)acetamido]methyl}-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide|N-((4-(4-fluorophenyl)-5-((2-((5-methyl-1,3,4-thiadiazol-2-yl)amino)-2-oxoethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)-2-(4-methoxyphenyl)acetamide|N-[[4-(4-fluorophenyl)-5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide|N-(5-methyl-1,3,4-thiadiazol-2-yl)[4-(p-fluorophenyl)-5-({[(p-methoxyphenyl)methyl]carbonylamino}methyl)-4H-1,2,4-triazol-3-ylthio]acetamide

CAS: 392680-58-9
Molecular Formula C23H22FN7O3S2
Molecular Weight 527.121 g/mol
LogP 3.16462
Topological Polar Surface Area 123.92 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 9
Rotatable Bonds 10
Exact Mass 527.121
Monoisotopic Mass 527.121
Heavy Atoms 36
Complexity 1340.7585

Chemical Identifiers

CAS Number 392680-58-9
SMILES CC1=NN=C(S1)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)F)CNC(=O)CC4=CC=C(C=C4)OC

Product Overview

AC1MLW9G (CAS 392680-58-9), with molecular formula C23H22FN7O3S2 and molecular weight 527.121 g/mol. IUPAC: N-[[4-(4-fluorophenyl)-5-[2-[(5-methyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2,4-triazol-3-yl]methyl]-2-(4-methoxyphenyl)acetamide.

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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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