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1566-77-4 | Benzoic acid, 2-[[([1,1'-biphenyl]-4-ylamino)carbonyl]amino]-
CAS No: 1566-77-4 Catalog No: AG001OUV MDL No:
Product Description
Catalog Number:
AG001OUV
Chemical Name:
Benzoic acid, 2-[[([1,1'-biphenyl]-4-ylamino)carbonyl]amino]-
CAS Number:
1566-77-4
Molecular Formula:
C20H16N2O3
Molecular Weight:
332.3526
IUPAC Name:
2-[(4-phenylphenyl)carbamoylamino]benzoic acid
InChI:
InChI=1S/C20H16N2O3/c23-19(24)17-8-4-5-9-18(17)22-20(25)21-16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,(H,23,24)(H2,21,22,25)
InChI Key:
VSUYVUHEGCXXAU-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1C(=O)O)Nc1ccc(cc1)c1ccccc1
Properties
Complexity:
454
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.116g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
332.359g/mol
Monoisotopic Mass:
332.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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