ML198 - 10mM in DMSO , CAS No.1380716-06-2

CAS: 1380716-06-2 Cat. No.: M421440 Molecular Weight: 290.32 EC Number: 849-357-1
AVAILABLE TO ORDER
GRADE & PURITY 10mM in DMSO
Synonyms
HY-117861 | F90275 | N-(4-ethynylphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide | NCGC00188758-02 | HVZPJBKUFRREQC-UHFFFAOYSA-N | AC-36655 | AKOS027470058 | ML198 | MS-24141 | EX-A4786 | SCHEMBL9904601 | EN300-191509 | NCGC00188758-01 | Z1888
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
Size
USA
Germany (EU)*
Price
Qty
1ml
M421440-1ml
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$164.90

$241.90
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs 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.

Overview

Information

ML198 is an activator and non-inhibitory chaperone of glucocerebrosidase (GCase).

Specifications

Synonyms
HY-117861 | F90275 | N-(4-ethynylphenyl)-5, 7-dimethylpyrazolo[1, 5-a]pyrimidine-3-carboxamide | NCGC00188758-02 | HVZPJBKUFRREQC-UHFFFAOYSA-N | AC-36655 | AKOS027470058 | ML198 | MS-24141 | EX-A4786 | SCHEMBL9904601 | EN300-191509 | NCGC00188758-01 | Z1888
Specifications & Purity
10mM in DMSO
Biochemical and Physiological Mechanisms
ML198 is an activator and non-inhibitory chaperone of glucocerebrosidase (GCase).
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
MODULATOR
Names and Identifiers
Pubchem Sid528765517
Canonical SmilesCC1=CC(=NC2=C(C=NN12)C(=O)NC3=CC=C(C=C3)C#C)C
IUPAC NameN-(4-ethynylphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
InChIKeyHVZPJBKUFRREQC-UHFFFAOYSA-N
INCHI1S/C17H14N4O/c1-4-13-5-7-14(8-6-13)20-17(22)15-10-18-21-12(3)9-11(2)19-16(15)21/h1,5-10H,2-3H3,(H,20,22)
Isomeric SMILES CC1=CC(=NC2=C(C=NN12)C(=O)NC3=CC=C(C=C3)C#C)C
Molecular Weight 290.32
Reaxy-Rn 22611936
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22611936&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
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassAnilides
Intermediate Tree Nodes Not available
Direct ParentAromatic anilides
Alternative Parents Pyrimidinecarboxamides  Pyrazolo[1,5-a]pyrimidines  Pyrazole-4-carboxamides  Vinylogous amides  Heteroaromatic compounds  Secondary carboxylic acid amides  Azacyclic compounds  Acetylides  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Aromatic anilide - Pyrazolopyrimidine - Pyrimidinecarboxamide - Pyrazolo[1,5-a]pyrimidine - Pyrazole-4-carboxamide - Pyrimidine - Azole - Pyrazole - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Organoheterocyclic compound - Acetylide - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
DescriptionThis 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
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
GBA1 Tclin Beta-glucocerebrosidase (14647 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GAA Tclin Lysosomal alpha-glucosidase (35701 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Caco-2 (12174 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Brain (1 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Plasma (328 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Molecular Weight290.320 g/mol
XLogP32.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass290.117 Da
Monoisotopic Mass290.117 Da
Topological Polar Surface Area59.300 Ų
Heavy Atom Count22
Formal Charge0
Complexity463.000
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
Solution Calculators
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