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Home> Encyclopedia > Hot Product Listed 5   > 5-Thiazoleacetic acid,2-[2-(4-fluorophenyl)ethenyl]-4-phenyl-
881040-88-6 structure

5-Thiazoleacetic acid,2-[2-(4-fluorophenyl)ethenyl]-4-phenyl-

Iupac Name:N-[2-(7-ethyl-2-phenyl-1H-indol-3-yl)ethyl]acetamide
CAS No.:881040-88-6
Molecular Weight:306.409
Molecular Formula:C19H26CL2N2O (isomer)
Names and Identifiers
Synonyms

2-(2-(4-Fluorophenyl)ethenyl)-4-phenyl-5-thiazoleacetic acid 2-[2-[(E)-2-(4-fluorophenyl)ethenyl]-4-phenyl-1,3-thiazol-5-yl]acetic acid 5-Thiazoleacetic acid, 2-(2-(4-fluorophenyl)ethenyl)-4-phenyl- AC1O5243 LS-150740

Inchi
InChI=1S/C20H22N2O/c1-3-15-10-7-11-17-18(12-13-21-14(2)23)20(22-19(15)17)16-8-5-4-6-9-16/h4-11,22H,3,12-13H2,1-2H3,(H,21,23)
InChkey
OQPKKIVOKWKTLC-UHFFFAOYSA-N
Canonical Smiles
CCC1=CC=CC2=C1NC(=C2CCNC(=O)C)C3=CC=CC=C3
Properties
Density
1.67
Flash Point
°C
Computational chemical data
  • Molecular Weight:306.409g/mol
  • Molecular Formula:C19H26CL2N2O
  • Compound Is Canonicalized:True
  • Exact Mass:306.173
  • Monoisotopic Mass:306.173
  • Complexity:391
  • Rotatable Bond Count:5
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:44.9A^2
  • Heavy Atom Count:23
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB7IAAAAAAAAAAAAAAAAAAAAWAAAAAwYAAAAAAAAFgB9AAAHgAQAAAADAjBngQywPLJkACo AyVyVACCgCAhACAImaAoRJgIIOLAkZGEIAhglgDIyAcQgMAOgAACAAACAAAAAAQAAAQAAAAAAAAA AA==
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