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140934-46-9 | Benzoic acid, 2-[[2-[(4-methoxyphenyl)amino]acetyl]amino]-
CAS No: 140934-46-9 Catalog No: AG001FNT MDL No:
Product Description
Catalog Number:
AG001FNT
Chemical Name:
Benzoic acid, 2-[[2-[(4-methoxyphenyl)amino]acetyl]amino]-
CAS Number:
140934-46-9
Molecular Formula:
C16H16N2O4
Molecular Weight:
300.3092
IUPAC Name:
2-[[2-(4-methoxyanilino)acetyl]amino]benzoic acid
InChI:
InChI=1S/C16H16N2O4/c1-22-12-8-6-11(7-9-12)17-10-15(19)18-14-5-3-2-4-13(14)16(20)21/h2-9,17H,10H2,1H3,(H,18,19)(H,20,21)
InChI Key:
KFSLWYUFYFKGRO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NCC(=O)Nc1ccccc1C(=O)O
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.111g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
300.314g/mol
Monoisotopic Mass:
300.111g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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