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· · COA & SDS Disponible para cada producto · Same-day shipping on in-stock items MK-2048 - Moligand™, ≥98% , CAS No.869901-69-9
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98% Synonyms
(6S)-2-((3-Chloro-4-fluorophenyl)methyl)-8-ethyl-1,2,6,7,8,9-hexahydro-10-hydroxy-N,6-dimethyl-1,9-dioxopyrazino(1',2':1,5)pyrrolo(2,3-d)pyridazine-4-carboxamide | (6S)-2-[(3-chloro-4-fluoro-phenyl)methyl]-8-ethyl-10-hydroxy-N,6-dimethyl-1,9-dioxo-6,7-dih
Shipped In
Hielera + almohadillas de hielo
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Why this grade Moligand™, ≥98% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Conservar a -20°C Ships Hielera + almohadillas de hielo Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Descripción general
MK-2048 is a potent inhibitor of integrase (IN) and INR263K with IC50 of 2.6 nM and 1.5 nM, respectively.
Specifications Sinónimos
(6S)-2-((3-Chloro-4-fluorophenyl)methyl)-8-ethyl-1, 2, 6, 7, 8, 9-hexahydro-10-hydroxy-N, 6-dimethyl-1, 9-dioxopyrazino(1', 2':1, 5)pyrrolo(2, 3-d)pyridazine-4-carboxamide | (6S)-2-[(3-chloro-4-fluoro-phenyl)methyl]-8-ethyl-10-hydroxy-N, 6-dimethyl-1, 9-dioxo-6, 7-dih
Especificaciones y pureza
Moligand™, ≥98%
Mecanismos bioquímicos y fisiológicos
MK-2048 es un inhibidor de la integrasa de segunda generación, destinado a ser utilizado contra la infección por VIH. El MK-2048 inhibe las actividades de la integrasa de los subtipos B y C. El MK-2048 inhibe los mutantes R263K de forma ligeramente más ef
Condiciones de almacenamiento de almacenamiento
Conservar a -20°C
Enviado en
Hielera + almohadillas de hielo
Nombres e identificadores Sonrisas canónicas CCN1CC(N2C3=C(C(=C2C1=O)O)C(=O)N(N=C3C(=O)NC)CC4=CC(=C(C=C4)F)Cl)C IUPAC Name (13S)-5-[(3-chloro-4-fluorophenyl)methyl]-11-ethyl-8-hydroxy-N,13-dimethyl-6,10-dioxo-1,4,5,11-tetrazatricyclo[7.4.0.02,7]trideca-2(7),3,8-triene-3-carboxamide InChIKey JSRREMIKIHJGAA-JTQLQIEISA-N INCHI 1S/C21H21ClFN5O4/c1-4-26-8-10(2)28-16-14(18(29)17(28)21(26)32)20(31)27(25-15(16)19(30)24-3)9-11-5-6-13(23)12(22)7-11/h5-7,10,29H,4,8-9H2,1-3H3,(H,24,30)/t10-/m0/s1 Isómeros SMILES CCN1C[C@@H](N2C3=C(C(=C2C1=O)O)C(=O)N(N=C3C(=O)NC)CC4=CC(=C(C=C4)F)Cl)C Peso molecular 461.87 Reaxy-Rn 22829520 Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22829520&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 Kingdom Organic compounds Superclass Organic acids and derivatives Clase Carboxylic acids and derivatives Subclass Carboxylic acid derivatives Intermediate Tree Nodes Carboxylic acid amides Direct Parent 2-heteroaryl carboxamides Alternative Parents Chlorobenzenes Fluorobenzenes Pyridazinones Substituted pyrroles Aryl fluorides Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Vinylogous acids Vinylogous amides Secondary carboxylic acid amides Lactams Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents 2-heteroaryl carboxamide - Chlorobenzene - Fluorobenzene - Halobenzene - Pyridazinone - Monocyclic benzene moiety - Aryl chloride - Aryl fluoride - Pyridazine - Aryl halide - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Vinylogous amide - Vinylogous acid - Pyrrole - Tertiary carboxylic acid amide - Lactam - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Organooxygen compound - Organonitrogen compound - Organofluoride - Organochloride - Organohalogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound Descripción This compound belongs to the class of organic compounds known as 2-heteroaryl carboxamides. These are compounds containing a heteroaromatic ring that carries a carboxamide 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.
Estructura 3D Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Solubilidad DMSO 9 mg/mL Water <1 mg/mL Ethanol <1 mg/mL Peso molecular 461.900 g/mol XLogP3 2.300 Hydrogen Bond Donor Count 2 Hydrogen Bond Acceptor Count 6 Rotatable Bond Count 4 Exact Mass 461.127 Da Monoisotopic Mass 461.127 Da Topological Polar Surface Area 107.000 Ų Heavy Atom Count 32 Formal Charge 0 Complexity 828.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 1 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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