AC1MXKYE structure

AC1MXKYE

1-(4-chlorophenyl)-3-[3-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethoxy]phenyl]prop-2-en-1-one

Also Known As: KS-000035JK|1-(4-chlorophenyl)-3-[3-(2-{4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazino}ethoxy)phenyl]-2-propen-1-one|1-(4-chlorophenyl)-3-[3-[2-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]ethoxy]phenyl]prop-2-en-1-one

CAS: 338409-25-9
Molecular Formula C27H24Cl2F3N3O2
Molecular Weight 549.11975 g/mol
LogP 6.5043
Topological Polar Surface Area 45.67 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 8
Exact Mass 549.11975
Monoisotopic Mass 549.11975
Heavy Atoms 37
Complexity 1258.4963

Chemical Identifiers

CAS Number 338409-25-9
SMILES C1CN(CCN1CCOC2=CC=CC(=C2)C=CC(=O)C3=CC=C(C=C3)Cl)C4=C(C=C(C=N4)C(F)(F)F)Cl

Product Overview

AC1MXKYE (CAS 338409-25-9), with molecular formula C27H24Cl2F3N3O2 and molecular weight 549.11975 g/mol. IUPAC: 1-(4-chlorophenyl)-3-[3-[2-[4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]ethoxy]phenyl]prop-2-en-1-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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