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GRADE & PURITY 10mM in DMSO
Synonyms
N1-Hydroxy-N3-(2-phenylethyl)-1,3-benzenedicarboxamide;N1-Hydroxy-N3-phenethylisophthalamide;N-Hydroxy-N′-phenethyl-isophthalamide;N1-hydroxy-N3-phenethylisophthalamide
Shipped In
Dry ice packs + Cold packs
Specifications Synonyms
N1-Hydroxy-N3-(2-phenylethyl)-1, 3-benzenedicarboxamide;N1-Hydroxy-N3-phenethylisophthalamide;N-Hydroxy-N′-phenethyl-isophthalamide;N1-hydroxy-N3-phenethylisophthalamide
Specifications & Purity
10mM in DMSO
Biochemical and Physiological Mechanisms
Dual histone deacetylase (HDAC) 6/8 inhibitor. IC50values are 0.036 μM, 0.12 μM, 9 μM, >33 μM, for HDAC6, HDAC8, HDAC2 and HDAC4, respectively.
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles C1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)C(=O)NO IUPAC Name 3-N-hydroxy-1-N-(2-phenylethyl)benzene-1,3-dicarboxamide InChIKey FIHKWEQJEDRIFS-UHFFFAOYSA-N INCHI 1S/C16H16N2O3/c19-15(17-10-9-12-5-2-1-3-6-12)13-7-4-8-14(11-13)16(20)18-21/h1-8,11,21H,9-10H2,(H,17,19)(H,18,20) Isomeric SMILES C1=CC=C(C=C1)CCNC(=O)C2=CC(=CC=C2)C(=O)NO Molecular Weight 284.31 Reaxy-Rn 23701772 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=23701772&ln=
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
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Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
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Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Benzoic acids and derivatives Intermediate Tree Nodes Not available Direct Parent Benzamides Alternative Parents Benzoyl derivatives Secondary carboxylic acid amides Hydroxamic acids Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Benzamide - Benzoyl - Secondary carboxylic acid amide - Hydroxamic acid - Carboxamide group - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 172-175ºC Molecular Weight 284.310 g/mol XLogP3 1.900 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 3 Rotatable Bond Count 5 Exact Mass 284.116 Da Monoisotopic Mass 284.116 Da Topological Polar Surface Area 78.400 Ų Heavy Atom Count 21 Formal Charge 0 Complexity 353.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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