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940507-15-3 | 4-Oxo-4-{3-[(3-phenylpropanoyl)amino]-anilino}butanoic acid
CAS No: 940507-15-3 Catalog No: AG01FOC2 MDL No:
Product Description
Catalog Number:
AG01FOC2
Chemical Name:
4-Oxo-4-{3-[(3-phenylpropanoyl)amino]-anilino}butanoic acid
CAS Number:
940507-15-3
IUPAC Name:
4-oxo-4-[3-(3-phenylpropanoylamino)anilino]butanoic acid
InChI:
InChI=1S/C19H20N2O4/c22-17(10-9-14-5-2-1-3-6-14)20-15-7-4-8-16(13-15)21-18(23)11-12-19(24)25/h1-8,13H,9-12H2,(H,20,22)(H,21,23)(H,24,25)
InChI Key:
OEKOVQJLYNSHHP-UHFFFAOYSA-N
Properties
Complexity:
460
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
340.142g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
340.379g/mol
Monoisotopic Mass:
340.142g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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