AC1OBTKP structure

AC1OBTKP

(E)-4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-[(E)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]-1,3-thiazol-2-imine

Also Known As: (2Z)-4-(4-Chlorophenyl)-2-[(4-methoxyphenyl)imino]-N-[[1-phenyl-3-(2-thienyl)-1H-pyrazol-4-yl]methylene]-3(2H)-thiazolamine|4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-[(E)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]-1,3-thiazol-2-imine

CAS: 957005-97-9
Molecular Formula C30H22ClN5OS2
Molecular Weight 567.09546 g/mol
LogP 7.9074
Topological Polar Surface Area 56.7 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 7
Exact Mass 567.09546
Monoisotopic Mass 567.09546
Heavy Atoms 39
Complexity 1783.2471

Chemical Identifiers

CAS Number 957005-97-9
SMILES COC1=CC=C(C=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)Cl)/N=C/C4=CN(N=C4C5=CC=CS5)C6=CC=CC=C6

Product Overview

AC1OBTKP (CAS 957005-97-9), with molecular formula C30H22ClN5OS2 and molecular weight 567.09546 g/mol. IUPAC: (E)-4-(4-chlorophenyl)-N-(4-methoxyphenyl)-3-[(E)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]-1,3-thiazol-2-imine.

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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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