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639005-98-4 | 4H-Imidazol-4-one, 5-[(3,4-diethoxyphenyl)methylene]-3,5-dihydro-2-(2-methylphenyl)-3-(phenylmethyl)-
CAS No: 639005-98-4 Catalog No: AG00EX73 MDL No:
Product Description
Catalog Number:
AG00EX73
Chemical Name:
4H-Imidazol-4-one, 5-[(3,4-diethoxyphenyl)methylene]-3,5-dihydro-2-(2-methylphenyl)-3-(phenylmethyl)-
CAS Number:
639005-98-4
IUPAC Name:
(5Z)-3-benzyl-5-[(3,4-diethoxyphenyl)methylidene]-2-(2-methylphenyl)imidazol-4-one
InChI:
InChI=1S/C28H28N2O3/c1-4-32-25-16-15-22(18-26(25)33-5-2)17-24-28(31)30(19-21-12-7-6-8-13-21)27(29-24)23-14-10-9-11-20(23)3/h6-18H,4-5,19H2,1-3H3/b24-17-
InChI Key:
PVJNQMJNCYTYJV-ULJHMMPZSA-N
Properties
Complexity:
712
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
440.21g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
440.543g/mol
Monoisotopic Mass:
440.21g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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