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1566-86-5 | Benzoic acid, 2-[[[(2-methoxyphenyl)amino]carbonyl]amino]-
CAS No: 1566-86-5 Catalog No: AG001OUS MDL No:
Product Description
Catalog Number:
AG001OUS
Chemical Name:
Benzoic acid, 2-[[[(2-methoxyphenyl)amino]carbonyl]amino]-
CAS Number:
1566-86-5
Molecular Formula:
C15H14N2O4
Molecular Weight:
286.2827
IUPAC Name:
2-[(2-methoxyphenyl)carbamoylamino]benzoic acid
InChI:
InChI=1S/C15H14N2O4/c1-21-13-9-5-4-8-12(13)17-15(20)16-11-7-3-2-6-10(11)14(18)19/h2-9H,1H3,(H,18,19)(H2,16,17,20)
InChI Key:
XSASBPLXMONVEH-UHFFFAOYSA-N
SMILES:
COc1ccccc1NC(=O)Nc1ccccc1C(=O)O
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
286.287g/mol
Monoisotopic Mass:
286.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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