SMN-C3 - Moligand™,≥99% , CAS No.1449597-34-5

CAS: 1449597-34-5 Cat. No.: S651825 Summenformel: C₂₄H₂₈N₆O Molekulargewicht: 416.52 PubChem CID: 89741632

GRADE & PURITY Moligand™, ≥99%

Synonyms

MS-27253 | HY-112633 | UNII-MV8T2MCK57 | 1449597-34-5 | EX-A6251 | RG-7800 | SMN-C3 | 4H-Pyrido(1,2-a)pyrimidin-4-one, 2-(4,6-dimethylpyrazolo(1,5-a)pyrazin-2-yl)-7-(1-ethyl-4-piperidinyl)-9-methyl- | 2-(4,6-Dimethylpyrazolo(1,5-a)pyrazin-2-yl)-7-(1-ethyl

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Übersicht

SMN-C3 is an orally active SMN2 splicing modulator and has the potential to treat spinal muscular atrophy (SMA).

In Vivo

At P16, vehicle treated D7 mice are much smaller than heterozygous littermate controls and appear moribund. In contrast, D7 mice treated with the high dose of SMN-C3 show a phenotype similar to that of heterozygous controls. SMN-C3 treatment induces a dose-dependent bodyweight gain in the D7 mice, with some animals showing a body weight that is ~80% that of heterozygous controls. SMN-C3 normalizes the motor behavior of D7 mice, illustrated by the ability of the mice to right themselves as quickly as heterozygous controls and by their level of locomotor activity. Most importantly, whereas vehicle-treated mice die within 3 weeks after birth with a median survival of 18 days, SMN-C3 treatment increases survival in a dose-dependent manner to a median survival time of 28 days in the low-dose (0.3 mg/kg per day) group. In the two higher-dose groups (1 and 3 mg/kg per day), ~90% of animals survive beyond P65 when the study is completed . MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

IC50& Target:SMN

Specifications

Synonyme

MS-27253 | HY-112633 | UNII-MV8T2MCK57 | 1449597-34-5 | EX-A6251 | RG-7800 | SMN-C3 | 4H-Pyrido(1,2-a)pyrimidin-4-one, 2-(4,6-dimethylpyrazolo(1,5-a)pyrazin-2-yl)-7-(1-ethyl-4-piperidinyl)-9-methyl- | 2-(4,6-Dimethylpyrazolo(1,5-a)pyrazin-2-yl)-7-(1-ethyl

Spezifikationen & Reinheit

Moligand™,≥99%

Biochemische und physiologische Mechanismen

SMN-C3 is an active SMN2 splicing modulator and has the potential to treat spinal muscular atrophy (SMA).

Storage

Store at -20°C,Argon charged

Verschickt in

Ice chest + Ice pads

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Note

Moligand™

Aktionsart

MODULATOR

Reinheit

≥99%

Namen und Kennungen

• Kanonisches Lächeln: CCN1CCC(CC1)C2=CN3C(=O)C=C(N=C3C(=C2)C)C4=NN5C=C(N=C(C5=C4)C)C
• IUPAC Name: 2-(4,6-dimethylpyrazolo[1,5-a]pyrazin-2-yl)-7-(1-ethylpiperidin-4-yl)-9-methylpyrido[1,2-a]pyrimidin-4-one
• InChIKey: ZACWYYKZMLGOTG-UHFFFAOYSA-N
• INCHI: 1S/C24H28N6O/c1-5-28-8-6-18(7-9-28)19-10-15(2)24-26-20(12-23(31)29(24)14-19)21-11-22-17(4)25-16(3)13-30(22)27-21/h10-14,18H,5-9H2,1-4H3
• Isomere SMILES: CCN1CCC(CC1)C2=CN3C(=O)C=C(N=C3C(=C2)C)C4=NN5C=C(N=C(C5=C4)C)C
• Alternative CAS-Nummer: 1449597-34-5
• PubChem CID: 89741632
• Molekulargewicht: 416.52

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridopyrimidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridopyrimidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridopyrimidines
• Alternative Parents: Pyrimidones Methylpyridines Aralkylamines Pyrazines Piperidines Pyrazoles Heteroaromatic compounds Trialkylamines Lactams Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Pyridopyrimidine - Methylpyridine - Aralkylamine - Pyrimidone - Piperidine - Pyrazine - Pyrimidine - Pyridine - Azole - Heteroaromatic compound - Pyrazole - Lactam - Tertiary aliphatic amine - Tertiary amine - Azacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as pyridopyrimidines. These are compounds containing a pyridopyrimidine, which consists of a pyridine fused to a pyrimidine. Pyridine is 6-membered ring consisting of five carbon atoms and a nitrogen atom. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
• 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.

DOI: 10.1186/s13321-016-0174-y

Zugehörige Ziele (nicht menschlich)

Abcb1b P-glycoprotein 1 (174 Activities)

Discover Target: Abcb1b

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: DMSO : 2.22 mg/mL (5.33 mM; ultrasonic and warming and heat to 60°C)
• Molekulargewicht: 416.500 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 416.232 Da
• Monoisotopic Mass: 416.232 Da
• Topological Polar Surface Area: 66.100 Ų
• Heavy Atom Count: 31
• Formal Charge: 0
• Complexity: 865.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

What is Moligand??

Moligand? is one of Aladdin Scientific's premium product lines, formulated for high-purity applications across multiple workflows. Compared to standard grades in the same workflow, Moligand? products typically offer tighter specifications, more rigorous QC, and stronger lot-to-lot consistency.

How should this product be stored?

Store at ?20 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1449597-34-5, the molecular formula is C24H28N6O, and the molecular weight is 416.52 g/mol. InChIKey ZACWYYKZMLGOTG-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.