WAY-296712 - 10mM in DMSO , CAS No.88530-99-8

CAS: 88530-99-8 Cat. No.: W426681 Formula: C₁₂H₁₀N₂O₂ Peso molecolare: 214.22 PubChem CID: 842059

QUALITÀ & PUREZZA 10mM in DMSO

Synonyms

88530-99-8|N-(2-Hydroxyphenyl)-2-pyridinecarboxamide|N-(2-hydroxyphenyl)picolinamide|N-(2-hydroxyphenyl)pyridine-2-carboxamide|BAS 00134377|WAY-296712|Oprea1_150731|Oprea1_753684|SCHEMBL5711050|DTXSID60357067|CHEBI:125618|HMS1679K17|EX-A6522|AKOS000525784

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Panoramica

Inhibitors of histone deacetylase

Specifiche

Sinonimi

88530-99-8 | N-(2-Hydroxyphenyl)-2-pyridinecarboxamide | N-(2-hydroxyphenyl)picolinamide | N-(2-hydroxyphenyl)pyridine-2-carboxamide | BAS 00134377 | WAY-296712 | Oprea1_150731 | Oprea1_753684 | SCHEMBL5711050 | DTXSID60357067 | CHEBI:125618 | HMS1679K17 | EX-A6522 | AKOS000525784

Specifiche e purezza

10mM in DMSO

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Proprietà del prodotto

ALogP

1.65

Conteggio HBD

2

Legame rotabile

2

Nomi e identificatori

Sorrisi canonici

C1=CC=C(C(=C1)NC(=O)C2=CC=CC=N2)O

IUPAC Name

N-(2-hydroxyphenyl)pyridine-2-carboxamide

InChIKey

VQNPYGMCQVAXJZ-UHFFFAOYSA-N

INCHI

1S/C12H10N2O2/c15-11-7-2-1-5-9(11)14-12(16)10-6-3-4-8-13-10/h1-8,15H,(H,14,16)

Isomeri SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=CC=N2)O

PubChem CID

842059

Peso molecolare

214.22

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Anilides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Anilides
• Intermediate Tree Nodes: Not available
• Direct Parent: Aromatic anilides
• Alternative Parents: Pyridinecarboxamides 2-heteroaryl carboxamides 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aromatic anilide - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - 2-heteroaryl carboxamide - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyridine - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as aromatic anilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with an aromatic group. They have the general structure RNC(=O)R', where R= benzene, and R = aryl group.
• 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.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• DMSO (mM) Solubilità massima: 10
• Peso molecolare: 214.220 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 214.074 Da
• Monoisotopic Mass: 214.074 Da
• Topological Polar Surface Area: 62.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 245.000
• 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