AC1OLX77 structure

AC1OLX77

(Z)-3-(3-chloro-4-fluoroanilino)-2-(4-naphthalen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile

Also Known As: (Z)-3-((3-chloro-4-fluorophenyl)amino)-2-(4-(naphthalen-2-yl)thiazol-2-yl)acrylonitrile|(Z)-3-(3-chloro-4-fluoroanilino)-2-(4-naphthalen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile|(2Z)-3-[(3-chloro-4-fluorophenyl)amino]-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

CAS: 683258-56-2
Molecular Formula C22H13ClFN3S
Molecular Weight 405.05026 g/mol
LogP 6.73238
Topological Polar Surface Area 48.71 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 4
Rotatable Bonds 4
Exact Mass 405.05026
Monoisotopic Mass 405.05026
Heavy Atoms 28
Complexity 1239.9996

Chemical Identifiers

CAS Number 683258-56-2
SMILES C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)/C(=C\NC4=CC(=C(C=C4)F)Cl)/C#N

Product Overview

AC1OLX77 (CAS 683258-56-2), with molecular formula C22H13ClFN3S and molecular weight 405.05026 g/mol. IUPAC: (Z)-3-(3-chloro-4-fluoroanilino)-2-(4-naphthalen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile.

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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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