HCV-796 (Nesbuvir) - ≥98% , Hepatitis C virus NS5B RNA-dependent RNA polymerase inhibitor, CAS No.691852-58-1, Hepatitis C virus NS5B RNA-dependent RNA polymerase inhibitor

CAS: 691852-58-1 Cat. No.: N127338 Peso molecular: 446.49
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
PB24322 | SCHEMBL2513096 | BDBM50454876 | PB42775 | 5-Cyclopropyl-2-(4-fluorophenyl)-6-((2-hydroxyethyl)(methylsulfonyl)amino)-N-methyl-1-benzofuran-3-carboxamide | F84824 | 5-cyclopropyl-2-(4-fluorophenyl)-6-[(2-hydroxyethyl)(methylsulfonyl)amino]-N-meth
Storage
Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
N127338-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
400,90US$
10mg
N127338-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
555,90US$
25mg
N127338-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.110,90US$
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
PB24322 | SCHEMBL2513096 | BDBM50454876 | PB42775 | 5-Cyclopropyl-2-(4-fluorophenyl)-6-((2-hydroxyethyl)(methylsulfonyl)amino)-N-methyl-1-benzofuran-3-carboxamide | F84824 | 5-cyclopropyl-2-(4-fluorophenyl)-6-[(2-hydroxyethyl)(methylsulfonyl)amino]-N-meth
Especificaciones y pureza
≥98%
Mecanismos bioquímicos y fisiológicos

Nesbuvir, a novel selective nonstructural protein 5B (NS5B) polymerase inhibitor, act as candidate for HCV treatment.

Condiciones de almacenamiento de almacenamiento
Store at -20°C
Enviado en
Ice chest + Ice pads
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Tipo de acción
INHIBITOR
Mecanismo de acción
Hepatitis C virus NS5B RNA-dependent RNA polymerase inhibitor
Pureza
≥98%
Propiedades del producto
ALogP2.7
Nombres e identificadores
Sonrisas canónicasCNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCO)S(=O)(=O)C)C4=CC=C(C=C4)F
IUPAC Name5-cyclopropyl-2-(4-fluorophenyl)-6-[2-hydroxyethyl(methylsulfonyl)amino]-N-methyl-1-benzofuran-3-carboxamide
InChIKeyWTDWVLJJJOTABN-UHFFFAOYSA-N
INCHI1S/C22H23FN2O5S/c1-24-22(27)20-17-11-16(13-3-4-13)18(25(9-10-26)31(2,28)29)12-19(17)30-21(20)14-5-7-15(23)8-6-14/h5-8,11-13,26H,3-4,9-10H2,1-2H3,(H,24,27)
Isómeros SMILES CNC(=O)C1=C(OC2=CC(=C(C=C21)C3CC3)N(CCO)S(=O)(=O)C)C4=CC=C(C=C4)F
Peso molecular 446.49
Reaxy-Rn 15493313
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=15493313&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
Clase2-arylbenzofuran flavonoids
SubclassNot available
Intermediate Tree Nodes Not available
Direct Parent2-arylbenzofuran flavonoids
Alternative Parents Lignans, neolignans and related compounds  2-phenylbenzofurans  Sulfanilides  Furan-3-carboxylic acid and derivatives  Fluorobenzenes  Aryl fluorides  Organosulfonamides  Organic sulfonamides  Heteroaromatic compounds  Aminosulfonyl compounds  Secondary carboxylic acid amides  Alkanolamines  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  Primary alcohols  Organofluorides  Organopnictogen compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 2-arylbenzofuran flavonoid - Neolignan skeleton - 2-phenylbenzofuran - Phenylbenzofuran - Sulfanilide - Benzofuran - Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Sulfonyl - Organosulfonic acid or derivatives - Furan - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Oxacycle - Alkanolamine - Carboxylic acid derivative - Alcohol - Organic oxide - Hydrocarbon derivative - Organopnictogen compound - Organohalogen compound - Organofluoride - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organosulfur compound - Primary alcohol - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as 2-arylbenzofuran flavonoids. These are phenylpropanoids containing the 2-phenylbenzofuran moiety.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
Huh-7 (12904 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NS5B Hepatitis C virus NS5B RNA-dependent RNA polymerase (3026 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Hepatitis C virus (23859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
NS5A Nonstructural protein 5A (2812 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
SolubilidadDMSO mg/mL Water mg/mL Ethanol mg/mL
Peso molecular446.500 g/mol
XLogP32.700
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass446.131 Da
Monoisotopic Mass446.131 Da
Topological Polar Surface Area108.000 Ų
Heavy Atom Count31
Formal Charge0
Complexity747.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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