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941464-00-2 | 4-{4-[(Methylanilino)carbonyl]anilino}-4-oxobutanoic acid
CAS No: 941464-00-2 Catalog No: AG01FOCT MDL No:
Product Description
Catalog Number:
AG01FOCT
Chemical Name:
4-{4-[(Methylanilino)carbonyl]anilino}-4-oxobutanoic acid
CAS Number:
941464-00-2
IUPAC Name:
4-[4-[methyl(phenyl)carbamoyl]anilino]-4-oxobutanoic acid
InChI:
InChI=1S/C18H18N2O4/c1-20(15-5-3-2-4-6-15)18(24)13-7-9-14(10-8-13)19-16(21)11-12-17(22)23/h2-10H,11-12H2,1H3,(H,19,21)(H,22,23)
InChI Key:
HVVDYJQKOFKSCT-UHFFFAOYSA-N
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.127g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
326.352g/mol
Monoisotopic Mass:
326.127g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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