DSP-4 - ≥98% (HPLC) , CAS No.40616-75-9

CAS: 40616-75-9 Cat. No.: D288182 Formula: C₁₁H₁₅BrClN·HCl Peso molecolare: 313.06

GRADE & PURITY ≥98%(HPLC)

Synonyms

1-Idrossi-2,3-dimetossi-10-metil-10H-acridin-9-one | N-(2-bromobenzil)-2-cloro-N-etiletan-1-amina cloridrato | DSP-4 (cloridrato) | HY-103210 | D81991 | EU-0100299 | SMR000326817 | N-(2-cloroetil)-N-etil-2-bromobenzilamina cloridrato, >=98

Storage

Conservare a -20°C

Shipped In

Cassetta del ghiaccio + cuscini per il ghiaccio

Panoramica

Il cloridrato DSP-4 (neurotossina DSP 4 cloridrato) è una neurotossina altamente selettiva e passa prontamente la barriera emato-encefalica con effetti neurotossici sui neuroni noradrenergici di ratti adulti e in via di sviluppo, può essere utilizzato per la degradazione selettiva temporanea dei neuroni noradrenergici centrali e periferici, principalmente quelli del locus coeruleus (LC)

Specifications

Sinonimi

1-Idrossi-2,3-dimetossi-10-metil-10H-acridin-9-one | N-(2-bromobenzil)-2-cloro-N-etiletan-1-amina cloridrato | DSP-4 (cloridrato) | HY-103210 | D81991 | EU-0100299 | SMR000326817 | N-(2-cloroetil)-N-etil-2-bromobenzilamina cloridrato, >=98

Specifiche e purezza

≥98% (HPLC)

Meccanismi biochimici e fisiologici

Neurotossina adrenergica. Ha effetti neurotossici sui neuroni noradrenergici sia periferici che centrali.

Condizioni di conservazione di stoccaggio

Conservare a -20°C

Spedito in

Cassetta del ghiaccio + cuscini per il ghiaccio

Purezza

≥98%(HPLC)

Nomi e identificatori

• Pubchem Sid: 504766821
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766821
• Sorrisi canonici: CCN(CCCl)CC1=CC=CC=C1Br.Cl
• IUPAC Name: N-[(2-bromophenyl)methyl]-2-chloro-N-ethylethanamine;hydrochloride
• InChIKey: NDDRNRRNYOULND-UHFFFAOYSA-N
• INCHI: 1S/C11H15BrClN.ClH/c1-2-14(8-7-13)9-10-5-3-4-6-11(10)12;/h3-6H,2,7-9H2,1H3;1H
• Isomeri SMILES: CCN(CCCl)CC1=CC=CC=C1Br.Cl
• WGK Germania: 3
• RTECS: DP1726100
• CAS alternativo: 62078-98-2
• Peso molecolare: 313.06

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmethylamines
• Alternative Parents: Benzylamines Bromobenzenes Aralkylamines Aryl bromides Trialkylamines Organopnictogen compounds Organochlorides Organobromides Organic chloride salts Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzylamine - Phenylmethylamine - Bromobenzene - Aralkylamine - Halobenzene - Aryl bromide - Aryl halide - Tertiary aliphatic amine - Tertiary amine - Alkyl chloride - Organonitrogen compound - Organochloride - Organobromide - Organohalogen compound - Organic salt - Organic chloride salt - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
• 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

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SLC6A3 Tclin Dopamine transporter (10535 Activities)

Discover Target: SLC6A3

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PLK1 Tchem Serine/threonine-protein kinase PLK1 (28605 Activities)

Discover Target: PLK1

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POLI Tchem DNA polymerase iota (116820 Activities)

Discover Target: POLI

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KDM4A Tchem Lysine-specific demethylase 4A (52245 Activities)

Discover Target: KDM4A

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APEX1 Tchem DNA-(apurinic or apyrimidinic site) lyase (38016 Activities)

Discover Target: APEX1

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

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LMNA Tbio Prelamin-A/C (36751 Activities)

Discover Target: LMNA

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BLM Tchem Bloom syndrome protein (4248 Activities)

Discover Target: BLM

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GMNN Tbio Geminin (128009 Activities)

Discover Target: GMNN

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Obiettivi associati (non umani)

Plasmodium falciparum (966862 Activities)

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Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)

Discover Target: Txnrd1

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Impa1 Inositol monophosphatase 1 (16203 Activities)

Discover Target: Impa1

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FTL Ferritin light chain (43324 Activities)

Discover Target: FTL

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nfo Endonuclease 4 (425 Activities)

Discover Target: nfo

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in DMSO, the highest concentration (mg/mL): 125, the highest concentration (mM):399.28(Need ultrasonic)
• Peso molecolare: 313.060 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 310.984 Da
• Monoisotopic Mass: 310.984 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 154.000
• 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

XLogP3

Riferimenti

1. Lina Ruan, Kaiyu Guan, Yue Wang, Ming Gu, Yue Chen, Lisha Cai, Ruixuan Ye, Zhengwei Huang, Anqi Guo, Zhengkang Su, Xi Li, Jianchun Pan.  (2022)  Baicalein exerts anxiolytic and antinociceptive effects in a mouse model of posttraumatic stress disorder: Involvement of the serotonergic system and spinal delta-opioid receptors.  PROGRESS IN NEURO-PSYCHOPHARMACOLOGY & BIOLOGICAL PSYCHIATRY,      [PMID:36462602] [10.1016/j.pnpbp.2022.110689]