AC1MIKS0 structure

AC1MIKS0

3-[4-(2-chlorophenyl)-1-phenylpyrazol-3-yl]oxy-N,N-dimethylpropan-1-amine;methanesulfonic acid

Also Known As: 1-Propanamine, 3-((4-(4-chlorophenyl)-1-phenyl-1H-pyrazol-3-yl)oxy)-N,N-dimethyl-, monomethanesulfonate|3-[4-(2-chlorophenyl)-1-phenyl-pyrazol-3-yl]oxy-N,N-dimethyl-propan-1-amine; Methanesulfonic Acid|3-[4-(2-chlorophenyl)-1-phenylpyrazol-3-yl]oxy-N,N-dimethylpropan-1-amine; methanesulfonic acid|Methanesulfonic acid--3-{[4-(2-chlorophenyl)-1-phenyl-1H-pyrazol-3-yl]oxy}-N,N-dimethylpropan-1-amine (1/1)

CAS: 62832-44-4
Molecular Formula C21H26ClN3O4S
Molecular Weight 451.13327 g/mol
LogP 4.0272
Topological Polar Surface Area 84.66 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 5
Rotatable Bonds 7
Exact Mass 451.13327
Monoisotopic Mass 451.13327
Heavy Atoms 30
Complexity 1029.4149

Chemical Identifiers

CAS Number 62832-44-4
SMILES CN(C)CCCOC1=NN(C=C1C2=CC=CC=C2Cl)C3=CC=CC=C3.CS(=O)(=O)O

Product Overview

AC1MIKS0 (CAS 62832-44-4), with molecular formula C21H26ClN3O4S and molecular weight 451.13327 g/mol. IUPAC: 3-[4-(2-chlorophenyl)-1-phenylpyrazol-3-yl]oxy-N,N-dimethylpropan-1-amine;methanesulfonic acid.

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