Quipazine dimaleate - ≥99% , CAS No.150323-78-7

CAS: 150323-78-7 Cat. No.: Q274905 Molecular Weight: 445.43 PubChem CID: 6420043

GRADE & PURITY ≥99%

Synonyms

HMS2096L16 | 2-(1-Piperazinyl)quinoline Dimaleate; 2-(1-Piperazinyl)quinoline (Z)-2-Butenedioate (1:2) | HMS3411K14 | SR-01000075574-1 | AKOS024458588 | Quipazine (dimaleate) | HMS1569L16 | SR-01000075574-7 | Prestwick_905 | Quipazinedimaleate | MS-28022

Storage

Room temperature,Desiccated

Shipped In

Normal

Overview

Store at Room Temperature. Store under desiccating conditions. The product can be stored for up to 12 months.

Specifications

Synonyms

HMS2096L16 | 2-(1-Piperazinyl)quinoline Dimaleate; 2-(1-Piperazinyl)quinoline (Z)-2-Butenedioate (1:2) | HMS3411K14 | SR-01000075574-1 | AKOS024458588 | Quipazine (dimaleate) | HMS1569L16 | SR-01000075574-7 | Prestwick_905 | Quipazinedimaleate | MS-28022

Specifications & Purity

≥99%

Biochemical and Physiological Mechanisms

5-HT receptor agonist, shows some selectivity at 5-HT 3 (EC 50 = 24 nM). Displays antidepressant and anorectic effect. Also promotes cellular proliferation.

Storage

Room temperature, Desiccated

Shipped In

Normal

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. Toxic, refer to SDS for further information. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 488195750
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488195750
• Canonical Smiles: C1CN(CCN1)C2=NC3=CC=CC=C3C=C2.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• IUPAC Name: (Z)-but-2-enedioic acid;2-piperazin-1-ylquinoline
• InChIKey: VAOSOCRJSSWBEQ-SPIKMXEPSA-N
• INCHI: 1S/C13H15N3.2C4H4O4/c1-2-4-12-11(3-1)5-6-13(15-12)16-9-7-14-8-10-16;2*5-3(6)1-2-4(7)8/h1-6,14H,7-10H2;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
• Isomeric SMILES: C1NCCN(C1)C2=NC3=CC=CC=C3C=C2.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O
• PubChem CID: 6420043
• Molecular Weight: 445.43

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazinanes
      • Subclass Piperazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazinanes
• Subclass: Piperazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinylpiperazines
• Alternative Parents: N-arylpiperazines Aminoquinolines and derivatives Dialkylarylamines Aminopyridines and derivatives Unsaturated fatty acids Imidolactams Dicarboxylic acids and derivatives Benzenoids Heteroaromatic compounds Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Not available
• Substituents: Pyridinylpiperazine - N-arylpiperazine - Aminoquinoline - Quinoline - Dialkylarylamine - Aminopyridine - Dicarboxylic acid or derivatives - Pyridine - Fatty acyl - Fatty acid - Imidolactam - Benzenoid - Unsaturated fatty acid - Heteroaromatic compound - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Azacycle - Secondary amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
• 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)

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

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U2OS (164939 Activities)

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EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

Discover Target: EHMT2

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

KDM4E Tchem Lysine-specific demethylase 4D-like (40243 Activities)

Discover Target: KDM4E

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PMP22 Tbio Peripheral myelin protein 22 (699 Activities)

Discover Target: PMP22

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HEK-293T (167025 Activities)

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Associated Targets(non-human)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)

Discover Target: Txnrd1

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nfo Endonuclease 4 (425 Activities)

Discover Target: nfo

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Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in water to 100 mM
• Molecular Weight: 445.400 g/mol
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 5
• Exact Mass: 445.149 Da
• Monoisotopic Mass: 445.149 Da
• Topological Polar Surface Area: 177.000 Ų
• Heavy Atom Count: 32
• Formal Charge: 0
• Complexity: 344.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 3

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