2-Hydroxypyridine - Moligand™, 10mM in DMSO , CAS No.142-08-5

CAS: 142-08-5 Cat. No.: H421556 Fórmula: C₅H₅NO Peso molecular: 95.1 Beilstein Registry Number: 105757 Número EC: 205-520-3

CALIDAD & PUREZA Moligand™, 10mM in DMSO

Synonyms

2-HYDROXYPYRIDINE|Pyridin-2-ol|142-08-5|2-Pyridone|2-Pyridinol|72762-00-6|pyridin-2(1H)-one|2(1H)-Pyridinone|1H-pyridin-2-one|2-Pyridinone|2(1H)-Pyridone|Pyridinone|alpha-Pyridone|2-Oxopyridine|pyridin-2-one|Pyridone-2|2-hydroxy pyridine|.alpha.-Pyridone|

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Especificaciones

Sinónimos

2-HYDROXYPYRIDINE | Pyridin-2-ol | 142-08-5 | 2-Pyridone | 2-Pyridinol | 72762-00-6 | pyridin-2(1H)-one | 2(1H)-Pyridinone | 1H-pyridin-2-one | 2-Pyridinone | 2(1H)-Pyridone | Pyridinone | alpha-Pyridone | 2-Oxopyridine | pyridin-2-one | Pyridone-2 | 2-hydroxy pyridine | .alpha.-Pyridone |

Especificaciones y pureza

Moligand™, 10mM in DMSO

Condiciones de almacenamiento de almacenamiento

Store at -80°C

Enviado en

Dry ice packs + Cold packs

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Grado

Moligand™

Nombres e identificadores

Pubchem Sid

528757564

Sonrisas canónicas

C1=CC(=O)NC=C1

IUPAC Name

1H-pyridin-2-one

InChIKey

UBQKCCHYAOITMY-UHFFFAOYSA-N

INCHI

1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)

Isómeros SMILES

C1=CC(=O)NC=C1

WGK Alemania

3

RTECS

UV1144050

CAS alternativo

72762-00-6

Peso molecular

95.1

Beilstein

105757

Reaxy-Rn

105757

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=105757&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyridines and derivatives
      • Subclass Hydropyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Hydropyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinones
• Alternative Parents: Dihydropyridines Heteroaromatic compounds Lactams Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridinone - Dihydropyridine - Heteroaromatic compound - Lactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyridinones. These are compounds containing a pyridine ring, which bears a ketone.
• External Descriptors: a small molecule

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

Objetivos asociados (humanos)

MIA PaCa-2 (5949 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

FKBP5 Tchem Peptidyl-prolyl cis-trans isomerase FKBP5 (259 Activities)

Discover Target: FKBP5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Objetivos asociados (no humanos)

Mmp9 Matrix metalloproteinase 9 (38 Activities)

Discover Target: Mmp9

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Light sensitive.
• Punto de inflamación (°C): 210°C
• Punto de ebullición (°C): 280-281°C
• Punto de fusión (°C): 106-107°C
• Peso molecular: 95.100 g/mol
• XLogP3: -0.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 95.0371 Da
• Monoisotopic Mass: 95.0371 Da
• Topological Polar Surface Area: 29.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 135.000
• 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