AC1LXSOQ structure

AC1LXSOQ

(E)-3-(3-chloro-4-fluoroanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Also Known As: AB00673307-01|F1110-0377|(E)-3-((3-chloro-4-fluorophenyl)amino)-2-(4-(3-nitrophenyl)thiazol-2-yl)acrylonitrile|(E)-3-(3-chloro-4-fluoroanilino)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile|(2E)-3-[(3-chloro-4-fluorophenyl)amino]-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

CAS: 683258-51-7
Molecular Formula C18H10ClFN4O2S
Molecular Weight 400.0197 g/mol
LogP 5.48738
Topological Polar Surface Area 91.85 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 400.0197
Monoisotopic Mass 400.0197
Heavy Atoms 27
Complexity 1090.9608

Chemical Identifiers

CAS Number 683258-51-7
SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)/C(=C/NC3=CC(=C(C=C3)F)Cl)/C#N

Product Overview

AC1LXSOQ (CAS 683258-51-7), with molecular formula C18H10ClFN4O2S and molecular weight 400.0197 g/mol. IUPAC: (E)-3-(3-chloro-4-fluoroanilino)-2-[4-(3-nitrophenyl)-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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