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5-HT Receptor
cerlapirdine , Serotonin 6 (5-HT6) receptor antagonist, CAS No.925448-93-7, Serotonin 6 (5-HT6) receptor antagonist

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cerlapirdine , Serotonin 6 (5-HT6) receptor antagonist, CAS No.925448-93-7, Serotonin 6 (5-HT6) receptor antagonist

COA

Grade & Purity:

Moligand™

Cas Number: 925448-93-7
Molecular Weight: 409.5
PubChem CID: 16071605

In stock

Item Number

C608479

Grouped product items
SKU	Size	Availability	Price	Qty
C608479-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,334.90
C608479-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,001.90

View related series

5-HT6 receptor Antagonist (36) Class A GPCR (4138)

Basic Description

Synonyms	F88545 \| fostemsavir & 4Dm2m \| GTPL12482 \| Cerlapirdine [USAN] \| N,N-dimethyl-3-[(3-naphthalen-1-ylsulfonyl-2H-indazol-5-yl)oxy]propan-1-amine \| 925448-93-7 (free base) \| Cerlapirdine \| BCP02840 \| CERLAPIRDINE [INN] \| SAM531 \| SAM-531 \| N,N-dimethyl-3-((3
Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	ANTAGONIST
Mechanism of action	Serotonin 6 (5-HT6) receptor antagonist

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Naphthalenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Naphthalenes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Naphthalenes
Alternative Parents	Indazoles Phenol ethers Alkyl aryl ethers Sulfones Pyrazoles Heteroaromatic compounds Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Naphthalene - Benzopyrazole - Indazole - Phenol ether - Alkyl aryl ether - Azole - Heteroaromatic compound - Pyrazole - Sulfone - Sulfonyl - Tertiary amine - Tertiary aliphatic amine - Ether - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors	Not available
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

Product Properties

ALogP	4.3

Associated Targets(Human)

HTR6 Tchem 5-hydroxytryptamine receptor 6 (3 Activities)

Discover Target: HTR6

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

HTR6 Tchem Serotonin 6 (5-HT6) receptor (9749 Activities)

Discover Target: HTR6

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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	N,N-dimethyl-3-[(3-naphthalen-1-ylsulfonyl-2H-indazol-5-yl)oxy]propan-1-amine
INCHI	InChI=1S/C22H23N3O3S/c1-25(2)13-6-14-28-17-11-12-20-19(15-17)22(24-23-20)29(26,27)21-10-5-8-16-7-3-4-9-18(16)21/h3-5,7-12,15H,6,13-14H2,1-2H3,(H,23,24)
InChIKey	NXQGEDVQXVTCDA-UHFFFAOYSA-N
Smiles	CN(C)CCCOC1=CC2=C(NN=C2C=C1)S(=O)(=O)C3=CC=CC4=CC=CC=C43
Isomeric SMILES	CN(C)CCCOC1=CC2=C(NN=C2C=C1)S(=O)(=O)C3=CC=CC4=CC=CC=C43
PubChem CID	16071605
Molecular Weight	409.5

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	409.500 g/mol
XLogP3	4.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	409.146 Da
Monoisotopic Mass	409.146 Da
Topological Polar Surface Area	83.700 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	636.000
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

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