BMS-908662 - Moligand™ , Serine/threonine-protein kinase RAF inhibitor, CAS No.870603-16-0, Serine/threonine-protein kinase RAF inhibitor

CAS: 870603-16-0 Cat. No.: B608141 Peso molecular: 462.9 PubChem CID: 56931136
Disponible para pedir
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.
Synonyms
Q27075375 | DW2NWI3TFN | DB12854 | XL 281 [WHO-DD] | BMS-908662 free base | XL281 | XL-281 | (+/-)-Methyl (5-(2-(5-chloro-2-methylphenyl)-1-hydroxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl)-1H-benzimidazol-2-yl)carbamate | BMS908662 | BMS-908662 | 1029873-02-6
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5mg
B608141-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
799,90US$
25mg
B608141-25mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.714,90US$
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Why this grade

Moligand™ Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships 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.

Specifications

Sinónimos
Q27075375 | DW2NWI3TFN | DB12854 | XL 281 [WHO-DD] | BMS-908662 free base | XL281 | XL-281 | (+/-)-Methyl (5-(2-(5-chloro-2-methylphenyl)-1-hydroxy-3-oxo-2, 3-dihydro-1H-isoindol-1-yl)-1H-benzimidazol-2-yl)carbamate | BMS908662 | BMS-908662 | 1029873-02-6
Especificaciones y pureza
Moligand™
Condiciones de almacenamiento de almacenamiento
Room temperature
Grado
Moligand™
Tipo de acción
INHIBITOR
Mecanismo de acción
Serine/threonine-protein kinase RAF inhibitor
Propiedades del producto
ALogP3.9
Nombres e identificadores
Sonrisas canónicasCOC(=O)Nc1nc2c([nH]1)cc(cc2)C1(O)c2ccccc2C(=O)N1c1cc(Cl)ccc1C
IUPAC Namemethyl N-[6-[2-(5-chloro-2-methylphenyl)-1-hydroxy-3-oxoisoindol-1-yl]-1H-benzimidazol-2-yl]carbamate
InChIKeyMMNNTJYFHUDSKL-UHFFFAOYSA-N
INCHI1S/C24H19ClN4O4/c1-13-7-9-15(25)12-20(13)29-21(30)16-5-3-4-6-17(16)24(29,32)14-8-10-18-19(11-14)27-22(26-18)28-23(31)33-2/h3-12,32H,1-2H3,(H2,26,27,28,31)
Isómeros SMILES CC1=C(C=C(C=C1)Cl)N2C(=O)C3=CC=CC=C3C2(C4=CC5=C(C=C4)N=C(N5)NC(=O)OC)O
PubChem CID 56931136
Peso molecular 462.9

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
SuperclassOrganoheterocyclic compounds
ClaseBenzimidazoles
Subclass2-benzimidazolylcarbamic acid esters
Intermediate Tree Nodes Not available
Direct Parent2-benzimidazolylcarbamic acid esters
Alternative Parents Isoindolones  Isoindoles  Toluenes  Chlorobenzenes  Aryl chlorides  Tertiary carboxylic acid amides  Imidazoles  Heteroaromatic compounds  Carbamate esters  Lactams  Alkanolamines  Azacyclic compounds  Carbonyl compounds  Hydrocarbon derivatives  Organic oxides  Organochlorides  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 2-benzimidazolylcarbamic acid ester - Isoindolone - Isoindole or derivatives - Isoindole - Isoindoline - Chlorobenzene - Toluene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Imidazole - Tertiary carboxylic acid amide - Carbamic acid ester - Heteroaromatic compound - Azole - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Alkanolamine - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as 2-benzimidazolylcarbamic acid esters. These are aromatic heteropolycyclic compounds that contain a carbamic acid ester group, which is N-linked to the C2-atom of a benzimidazole moiety.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
BRAF Tclin Serine/threonine-protein kinase B-raf (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
SK-MEL19 (54 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
Peso molecular462.900 g/mol
XLogP33.900
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass462.109 Da
Monoisotopic Mass462.109 Da
Topological Polar Surface Area108.000 Ų
Heavy Atom Count33
Formal Charge0
Complexity771.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
Reseñas

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