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940488-50-6 | 2-({3-[(Butylamino)carbonyl]anilino}carbonyl)-benzoic acid
CAS No: 940488-50-6 Catalog No: AG01FOCB MDL No:
Product Description
Catalog Number:
AG01FOCB
Chemical Name:
2-({3-[(Butylamino)carbonyl]anilino}carbonyl)-benzoic acid
CAS Number:
940488-50-6
IUPAC Name:
2-[[3-(butylcarbamoyl)phenyl]carbamoyl]benzoic acid
InChI:
InChI=1S/C19H20N2O4/c1-2-3-11-20-17(22)13-7-6-8-14(12-13)21-18(23)15-9-4-5-10-16(15)19(24)25/h4-10,12H,2-3,11H2,1H3,(H,20,22)(H,21,23)(H,24,25)
InChI Key:
PYKHZMSWSIGLBK-UHFFFAOYSA-N
Properties
Complexity:
480
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:
7
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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