Desipramine Hydrochloride - ≥98% , Norepinephrine transporter inhibitor, CAS No.58-28-6, Norepinephrine transporter inhibitor

CAS: 58-28-6 Cat. No.: D136408 Summenformel: C₁₈H₂₃ClN₂ Molekulargewicht: 302.84 EG-Nummer: 200-373-1

GRADE & PURITY ≥98%

Synonyms

DMI | EN300-7373300 | 10,f]azepine monohydrochloride | D 3900 | Desipramine hydrochloride | DESIPRAMINE HYDROCHLORIDE [JAN] | Desipramine hydrochloride [USAN:USP:JAN] | DESIPRAMINE HYDROCHLORIDE [WHO-DD] | PS02 - Imipramine/Desipramine | RMI 9,384A | 1Y58

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Übersicht

Desipramine, a metabolite of imipramine and iofepramine is an active tricyclic antidepressant.

Specifications

Synonyme

DMI | EN300-7373300 | 10,f]azepine monohydrochloride | D 3900 | Desipramine hydrochloride | DESIPRAMINE HYDROCHLORIDE [JAN] | Desipramine hydrochloride [USAN:USP:JAN] | DESIPRAMINE HYDROCHLORIDE [WHO-DD] | PS02 - Imipramine/Desipramine | RMI 9,384A | 1Y58

Spezifikationen & Reinheit

≥98%

Biochemische und physiologische Mechanismen

Tricyclic antidepressant that is a selective inhibitor of noradrenalin transporters (Kivalues are 4, 61 and 78720 nM for NET, SERT and DAT transporters respectively).

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Aktionsart

INHIBITOR

Mechanismus der Wirkung

Norepinephrine transporter inhibitor

Reinheit

≥98%

Namen und Kennungen

Pubchem Sid

504753975

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753975

Kanonisches Lächeln

CNCCCN1C2=CC=CC=C2CCC3=CC=CC=C31.Cl

IUPAC Name

3-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-N-methylpropan-1-amine;hydrochloride

InChIKey

XAEWZDYWZHIUCT-UHFFFAOYSA-N

INCHI

1S/C18H22N2.ClH/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20;/h2-5,7-10,19H,6,11-14H2,1H3;1H

Isomere SMILES

CNCCCN1C2=CC=CC=C2CCC3=CC=CC=C31.Cl

WGK Deutschland

1

Alternative CAS-Nummer

50-47-5

Molekulargewicht

302.84

Reaxy-Rn

4166006

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4166006&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Benzazepines
      • Subclass Dibenzazepines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Benzazepines
• Subclass: Dibenzazepines
• Intermediate Tree Nodes: Not available
• Direct Parent: Dibenzazepines
• Alternative Parents: Alkyldiarylamines Azepines Benzenoids Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Dibenzazepine - Alkyldiarylamine - Tertiary aliphatic/aromatic amine - Azepine - Benzenoid - Tertiary amine - Azacycle - Secondary amine - Secondary aliphatic amine - Amine - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organic nitrogen compound - Hydrochloride - Aromatic heteropolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as dibenzazepines. These are compounds with two benzene rings connected by an azepine ring. Azepine is an unsaturated seven-member heterocycle with one nitrogen atom replacing a carbon atom.
• External Descriptors: hydrochloride

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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SLC6A2 Tclin Sodium-dependent noradrenaline transporter (1 Activities)

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

SLC6A2 Tclin Norepinephrine transporter (10102 Activities)

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SLC6A4 Tclin Serotonin transporter (12625 Activities)

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SLC6A3 Tclin Dopamine transporter (10535 Activities)

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KCNH2 Tclin HERG (29587 Activities)

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TRPV1 Tclin Vanilloid receptor (8273 Activities)

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GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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Homo sapiens (32628 Activities)

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HEK293 (82097 Activities)

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HepG2 (196354 Activities)

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

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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

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SMN1 Tchem Survival motor neuron protein (34246 Activities)

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GMNN Tbio Geminin (128009 Activities)

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PMP22 Tbio Peripheral myelin protein 22 (699 Activities)

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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)

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BAZ2B Tchem Bromodomain adjacent to zinc finger domain protein 2B (56204 Activities)

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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)

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ATXN2 Tbio Ataxin-2 (54410 Activities)

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IDH1 Tclin Isocitrate dehydrogenase [NADP] cytoplasmic (40980 Activities)

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MEN1 Tchem Menin/Histone-lysine N-methyltransferase MLL (48157 Activities)

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ampC Beta-lactamase AmpC (62480 Activities)

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Pseudomonas aeruginosa (123386 Activities)

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Klebsiella pneumoniae (43867 Activities)

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Staphylococcus aureus (210822 Activities)

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Acinetobacter baumannii (41033 Activities)

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Escherichia coli (133304 Activities)

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Plasmodium falciparum (966862 Activities)

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Cryptococcus neoformans (21258 Activities)

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Candida albicans (78123 Activities)

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Mus musculus (284745 Activities)

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Npsr1 Neuropeptide S receptor (260 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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Txnrd1 Thioredoxin reductase 1, cytoplasmic (45279 Activities)

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Impa1 Inositol monophosphatase 1 (16203 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Solvent:water, Max Conc. mg/mL: 30.28, Max Conc. mM: 100
• Empfindlichkeit: Moisture sensitive；Air sensitive
• Flammpunkt (°F): 48.2 °F
• Flammpunkt (°C): 9 °C
• Molekulargewicht: 302.800 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 302.155 Da
• Monoisotopic Mass: 302.155 Da
• Topological Polar Surface Area: 15.300 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 267.000
• 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