AC1NXQ8F structure

AC1NXQ8F

11-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

Also Known As: BAS 00534130|11-[(5Z)-5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoic acid|(Z)-11-(5-(3-ethoxy-4-hydroxybenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)undecanoic acid|11-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid

CAS: 299952-91-3
Molecular Formula C23H31NO5S2
Molecular Weight 465.16437 g/mol
LogP 5.5876
Topological Polar Surface Area 87.07 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 14
Exact Mass 465.16437
Monoisotopic Mass 465.16437
Heavy Atoms 31
Complexity 809.1566

Chemical Identifiers

CAS Number 299952-91-3
SMILES CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=S)S2)CCCCCCCCCCC(=O)O)O

Product Overview

AC1NXQ8F (CAS 299952-91-3), with molecular formula C23H31NO5S2 and molecular weight 465.16437 g/mol. IUPAC: 11-[(5Z)-5-[(3-ethoxy-4-hydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]undecanoic acid.

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