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Home > Imidazoles > 568555-54-4
568555-54-4 | 3-benzoyl-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
CAS No: 568555-54-4 Catalog No: AG019I53 MDL No:MFCD03980939
Product Description
Catalog Number:
AG019I53
Chemical Name:
3-benzoyl-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
CAS Number:
568555-54-4
Molecular Formula:
C19H16N2O4S
Molecular Weight:
368.4063
MDL Number:
MFCD03980939
IUPAC Name:
3-benzoyl-5-[(2,4-dimethoxyphenyl)methylidene]-2-sulfanylideneimidazolidin-4-one
InChI:
InChI=1S/C19H16N2O4S/c1-24-14-9-8-13(16(11-14)25-2)10-15-18(23)21(19(26)20-15)17(22)12-6-4-3-5-7-12/h3-11H,1-2H3,(H,20,26)
InChI Key:
WKBRJSOQWXVUFM-UHFFFAOYSA-N
SMILES:
COc1cc(OC)ccc1C=C1NC(=S)N(C1=O)C(=O)c1ccccc1
Properties
Complexity:
600
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.083g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
368.407g/mol
Monoisotopic Mass:
368.083g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
100A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.2
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