Azaperone - 10mM in DMSO , CAS No.1649-18-9

CAS: 1649-18-9 Cat. No.: A422045 Formula: C₁₉H₂₂FN₃O Peso molecolare: 327.4 Numero EC: 216-715-8

QUALITÀ & PUREZZA 10mM in DMSO

Synonyms

AZAPERONE [MART.] | AZAPERONE [USP IMPURITY] | HMS3652D15 | Azaperone 100 microg/mL in Acetonitrile | BSPBio_003566 | Butyrophenone, 4'-fluoro-4-[4-(2-pyridyl)-1-piperazinyl]- | HMS3369I10 | NSC170976 | NSC-170976 | BRN 0565491 | Sedaperone vet | Stresnil

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Specifiche

Sinonimi

AZAPERONE [MART.] | AZAPERONE [USP IMPURITY] | HMS3652D15 | Azaperone 100 microg/mL in Acetonitrile | BSPBio_003566 | Butyrophenone, 4'-fluoro-4-[4-(2-pyridyl)-1-piperazinyl]- | HMS3369I10 | NSC170976 | NSC-170976 | BRN 0565491 | Sedaperone vet | Stresnil

Specifiche e purezza

10mM in DMSO

Meccanismi biochimici e fisiologici

Sedative and anaesthetic adjuvant. D 1 receptor antagonist. Shows immobilisations effects in vivo.

Condizioni di conservazione di stoccaggio

Store at -80°C

Spedito in

Dry ice packs + Cold packs

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

ANTAGONIST

Nomi e identificatori

Pubchem Sid

528763346

Sorrisi canonici

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=N3

IUPAC Name

1-(4-fluorophenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one

InChIKey

XTKDAFGWCDAMPY-UHFFFAOYSA-N

INCHI

1S/C19H22FN3O/c20-17-8-6-16(7-9-17)18(24)4-3-11-22-12-14-23(15-13-22)19-5-1-2-10-21-19/h1-2,5-10H,3-4,11-15H2

Isomeri SMILES

C1CN(CCN1CCCC(=O)C2=CC=C(C=C2)F)C3=CC=CC=N3

WGK Germania

3

RTECS

EU4550000

Peso molecolare

327.4

Reaxy-Rn

565491

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=565491&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Aryl ketones
            • Level7 Phenylketones
              • Level8 Alkyl-phenylketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones - Phenylketones
• Direct Parent: Alkyl-phenylketones
• Alternative Parents: Pyridinylpiperazines N-arylpiperazines Phenylbutylamines Butyrophenones Aryl alkyl ketones Dialkylarylamines Benzoyl derivatives Aminopyridines and derivatives N-alkylpiperazines Fluorobenzenes Aryl fluorides Imidolactams Gamma-amino ketones Heteroaromatic compounds Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl-phenylketone - Pyridinylpiperazine - N-arylpiperazine - Butyrophenone - Phenylbutylamine - Benzoyl - Dialkylarylamine - Aryl alkyl ketone - Aminopyridine - Fluorobenzene - Halobenzene - N-alkylpiperazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Gamma-aminoketone - Piperazine - Pyridine - Imidolactam - Benzenoid - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Organofluoride - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen compound - Organic oxide - Amine - Aromatic heteromonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl 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

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TMEM97 Tchem Sigma intracellular receptor 2 (2 Activities)

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SIGMAR1 Tclin Sigma non-opioid intracellular receptor 1 (3 Activities)

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DRD3 Tclin D(3) dopamine receptor (5 Activities)

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HTR2A Tclin 5-hydroxytryptamine receptor 2A (4 Activities)

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HTR1A Tclin 5-hydroxytryptamine receptor 1A (4 Activities)

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HTR1A Tclin Serotonin 1a (5-HT1a) receptor (14969 Activities)

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DRD2 Tclin Dopamine D2 receptor (23596 Activities)

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DRD4 Tchem Dopamine D4 receptor (7907 Activities)

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HTR2A Tclin Serotonin 2a (5-HT2a) receptor (14758 Activities)

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SLC6A4 Tclin Serotonin transporter (12625 Activities)

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DRD3 Tclin Dopamine D3 receptor (14368 Activities)

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CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)

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CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)

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CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Punto di fusione (°C): 87-89°C
• Peso molecolare: 327.400 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 327.175 Da
• Monoisotopic Mass: 327.175 Da
• Topological Polar Surface Area: 36.400 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 390.000
• 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