4424-17-3 | 2-Aminobenzanilide

Packsize	Purity	Availability	Price	Discounted Price
1g	97%	in stock	$50.00	$35.00
5g	97%	in stock	$122.00	$86.00
25g	97%	in stock	$449.00	$315.00

Description

• Catalog Number: AB61194
• Chemical Name: 2-Aminobenzanilide
• CAS Number: 4424-17-3
• Molecular Formula: C13H12N2O
• Molecular Weight: 212.2472
• MDL Number: MFCD00017096
• SMILES: O=C(c1ccccc1)Nc1ccccc1N
• NSC Number: 50644

Computed Properties

• Complexity: 236
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 2.9

Literature

• Design, synthesis, and biological evaluation of 2-aminobenzanilide derivatives as potent and selective HDAC inhibitors.

  ChemMedChem 20120701

• Interference of H-bonding and substituent effects in nitro- and hydroxy-substituted salicylaldehydes.

  Journal of molecular modeling 20120101

• Interrelations between the mesomeric and electronegativity effects in para-substituted derivatives of phenol/phenolate and aniline/anilide H-bonded complexes: a DFT-based computational study.

  The journal of physical chemistry. A 20090514

• Cyclooxygenase-1-selective inhibitors are attractive candidates for analgesics that do not cause gastric damage. design and in vitro/in vivo evaluation of a benzamide-type cyclooxygenase-1 selective inhibitor.

  Journal of medicinal chemistry 20080424

• Long-distance structural consequences of H-bonding. How H-bonding affects aromaticity of the ring in variously substituted aniline/anilinium/anilide complexes with bases and acids.

  Journal of chemical information and modeling 20070101

• Slow hydrogen atom self-exchange between Os(IV) anilide and Os(III) aniline complexes: relationships with electron and proton transfer self-exchange.

  Journal of the American Chemical Society 20031008