CP 339818 hydrochloride - Moligand™, ≥98% , Channel blocker of K v1.4;Channel blocker of K v1.7, CAS No.478341-55-8, Channel blocker of K v1.4;Channel blocker of K v1.7

CAS: 478341-55-8 Cat. No.: C275858 Molecular Weight: 340.89

GRADE & PURITY Moligand™, ≥98%

Synonyms

CP 339818 HYDROCHLORIDE | N-[1-(Phenylmethyl)-4(1H)-quinolinylidene]-1 pentanamine HCl | SCHEMBL6374497 | SB72858 | N-[1-(PHENYLMETHYL)-4(1H)-QUINOLINYLIDENE]-1 PENTANAMINE HYDROCHLORIDE | 1-benzyl-N-pentylquinolin-4-imine;hydrochloride | SR-01000597744 |

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Overview

CP 339818 hydrochloride is a non peptide selective Kv1.3 (IC50 value of approximately 200 nM) and Kv1.4 channel blocker. The blocking effect of CP 339818 hydrochloride on Kv1.1, Kv1.2, Kv1.5, Kv1.6, Kv3.1-4, and Kv4.2 is significantly poor. CP 339818 hydrochloride can effectively block the C-type inactive conformation of Kv1.3 and inhibit T cell activation.

Specifications

Synonyms

CP 339818 HYDROCHLORIDE | N-[1-(Phenylmethyl)-4(1H)-quinolinylidene]-1 pentanamine HCl | SCHEMBL6374497 | SB72858 | N-[1-(PHENYLMETHYL)-4(1H)-QUINOLINYLIDENE]-1 PENTANAMINE HYDROCHLORIDE | 1-benzyl-N-pentylquinolin-4-imine;hydrochloride | SR-01000597744 |

Specifications & Purity

Moligand™, ≥98%

Biochemical and Physiological Mechanisms

Potent, selective, competitive K V 1.3 and K V 1.4 channel blocker (IC 50 values are 200 and 300 nM for K V 1.3 and respectively). Binds preferentially to the C-type inactivated state. Suppresses T cell activation.

Storage

Store at -20°C, Desiccated

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

Moligand™

Action Type

CHANNEL BLOCKER

Mechanism of action

Channel blocker of K v1.4;Channel blocker of K v1.7

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CCCCCN=C1C=CN(C2=CC=CC=C12)CC3=CC=CC=C3.Cl
• IUPAC Name: 1-benzyl-N-pentylquinolin-4-imine;hydrochloride
• InChIKey: JIRISCAPZWLWCG-UHFFFAOYSA-N
• INCHI: 1S/C21H24N2.ClH/c1-2-3-9-15-22-20-14-16-23(17-18-10-5-4-6-11-18)21-13-8-7-12-19(20)21;/h4-8,10-14,16H,2-3,9,15,17H2,1H3;1H
• Isomeric SMILES: CCCCCN=C1C=CN(C2=CC=CC=C12)CC3=CC=CC=C3.Cl
• WGK Germany: 3
• Alternate CAS: 185855-91-8
• Molecular Weight: 340.89
• Reaxy-Rn: 33872772
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=33872772&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Quinolines and derivatives
      • Subclass 1-benzylquinolines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Quinolines and derivatives
• Subclass: 1-benzylquinolines
• Intermediate Tree Nodes: Not available
• Direct Parent: 1-benzylquinolines
• Alternative Parents: Hydroquinolines Pyridines and derivatives Benzene and substituted derivatives Secondary ketimines Heteroaromatic compounds Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 1-benzylquinoline - Dihydroquinoline - Benzenoid - Pyridine - Monocyclic benzene moiety - Heteroaromatic compound - Secondary ketimine - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as 1-benzylquinolines. These are organic aromatic compounds containing a quinoline that is substituted at the 1-position by a benzyl group.
• 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

Associated Targets(Human)

KCNA7 Tclin Potassium voltage-gated channel subfamily A member 7 (1 Activities)

Discover Target: KCNA7

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

KCNA4 Tclin Potassium voltage-gated channel subfamily A member 4 (1 Activities)

Discover Target: KCNA4

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

Chemical and Physical Properties

• Solubility: Soluble in water to 25 mM and in DMSO to 25 mM
• Sensitivity: Moisture sensitive.
• Molecular Weight: 340.900 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 340.171 Da
• Monoisotopic Mass: 340.171 Da
• Topological Polar Surface Area: 15.600 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 406.000
• 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: 2

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