AC1MD1B8 structure

AC1MD1B8

[(4,6-dichloro-2-methylsulfanylpyrimidin-5-yl)methylideneamino] N-[4-(trifluoromethoxy)phenyl]carbamate

Also Known As: 4,6-dichloro-2-(methylthio)-5-{[({[4-(trifluoromethoxy)anilino]carbonyl}oxy)imino]methyl}pyrimidine|[(4,6-dichloro-2-methylsulfanylpyrimidin-5-yl)methylideneamino] N-[4-(trifluoromethoxy)phenyl]carbamate

CAS: 680217-34-9
Molecular Formula C14H9Cl2F3N4O3S
Molecular Weight 439.97244 g/mol
LogP 4.9865
Topological Polar Surface Area 85.7 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 439.97244
Monoisotopic Mass 439.97244
Heavy Atoms 27
Complexity 827.4866

Chemical Identifiers

CAS Number 680217-34-9
SMILES CSC1=NC(=C(C(=N1)Cl)C=NOC(=O)NC2=CC=C(C=C2)OC(F)(F)F)Cl

Product Overview

AC1MD1B8 (CAS 680217-34-9), with molecular formula C14H9Cl2F3N4O3S and molecular weight 439.97244 g/mol. IUPAC: [(4,6-dichloro-2-methylsulfanylpyrimidin-5-yl)methylideneamino] N-[4-(trifluoromethoxy)phenyl]carbamate.

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