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ACT 462206 - ≥99%(HPLC), high purity , CAS No.1361321-96-1, Antagonist of OX 1 receptor;Antagonist of OX 2 receptor

Item Number
A287294
Grouped product items
SKUSizeAvailabilityPrice Qty
A287294-5mg
5mg
In stock
$102.90
A287294-10mg
10mg
In stock
$167.90
A287294-25mg
25mg
In stock
$352.90
A287294-50mg
50mg
In stock
$563.90
A287294-100mg
100mg
In stock
$890.90
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Potent, dual orexin receptor antagonist

View related series
GPCR/G Protein Neuronal Signaling Orexin Receptor (OX Receptor) OX1 receptor Antagonist OX2 receptor Antagonist

Basic Description

SynonymsACT 462206 | MS-26450 | NCGC00387479-01 | (S)-N-(3,5-dimethylphenyl)-1-((4-methoxyphenyl)sulfonyl)-pyrrolidine-2-carboxamide | ACT462206 | ACT-462206 | ACT-462206, >=98% (HPLC) | (2~{S})-~{N}-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-
Specifications & PurityMoligand™, ≥99%(HPLC)
Biochemical and Physiological MechanismsPotent, dual orexin receptor antagonist (IC50values are 11 and 60 nM for OX2and OX1receptors respectively). Exhibits anxiolytic-like propertiesin vivo. Brain penetrant.ACT-462206 is a orally active, brain penetrant, potent and selective dual orexin1/2 rec
Storage TempStore at 2-8°C
Shipped InWet ice
GradeMoligand™
Action TypeANTAGONIST
Mechanism of actionAntagonist of OX 1 receptor;Antagonist of OX 2 receptor

Associated Targets(Human)

HCRTR1 Tclin Orexin receptor type 1 (5 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HCRTR2 Tclin Orexin receptor type 2 (5 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
HCRTR1 Tclin Orexin receptor 1 (5435 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HCRTR2 Tclin Orexin receptor 2 (5902 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Homo sapiens (32628 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Associated Targets(non-human)

Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Canis familiaris (36305 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDCK (10148 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Mechanisms of Action

Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Names and Identifiers

IUPAC Name (2S)-N-(3,5-dimethylphenyl)-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxamide
INCHI InChI=1S/C20H24N2O4S/c1-14-11-15(2)13-16(12-14)21-20(23)19-5-4-10-22(19)27(24,25)18-8-6-17(26-3)7-9-18/h6-9,11-13,19H,4-5,10H2,1-3H3,(H,21,23)/t19-/m0/s1
InChi Key NHPQGZOBHSVTAQ-IBGZPJMESA-N
Canonical SMILES CC1=CC(=CC(=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)OC)C
Isomeric SMILES CC1=CC(=CC(=C1)NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)OC)C
Alternate CAS 1361321-96-1
PubChem CID 40924317
MeSH Entry Terms ACT-462206
Molecular Weight 388.48

Certificates

Certificate of Analysis(COA)

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5 results found

Lot NumberCertificate TypeDateItem
K2215135Certificate of AnalysisAug 06, 2022 A287294
K2215138Certificate of AnalysisAug 06, 2022 A287294
K2215139Certificate of AnalysisAug 06, 2022 A287294
K2215140Certificate of AnalysisAug 06, 2022 A287294
K2215143Certificate of AnalysisAug 06, 2022 A287294

Chemical and Physical Properties

SolubilitySolvent:DMSO, Max Conc. mg/mL: 38.85, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 38.85, Max Conc. mM: 100

Safety and Hazards(GHS)

RIDADR NONHforallmodesoftransport

Related Documents

 SDS

 Specification Sheet

References

1. Hoch M, van Gorsel H, van Gerven J, Dingemanse J.  (2014)  Entry-into-humans study with ACT-462206, a novel dual orexin receptor antagonist, comparing its pharmacodynamics with almorexant..  J Clin Pharmacol,  54  (9): (979-86).  [PMID:24691844] [10.1021/op500134e]
2. Boss C, Roch-Brisbare C, Steiner MA, Treiber A, Dietrich H, Jenck F, von Raumer M, Sifferlen T, Brotschi C, Heidmann B et al..  (2014)  Structure-activity relationship, biological, and pharmacological characterization of the proline sulfonamide ACT-462206: a potent, brain-penetrant dual orexin 1/orexin 2 receptor antagonist..  ChemMedChem,  9  (11): (2486-96).  [PMID:25147058] [10.1021/op500134e]

Solution Calculators

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