Mefexamide hydrochloride - ≥98% , CAS No.1227-61-8

CAS: 1227-61-8 Cat. No.: M302661 Summenformel: C15H24N2O3·HCl Molekulargewicht: 316.82 EG-Nummer: 214-963-1

GRADE & PURITY ≥98%

Synonyms

mefexamide|Timodyne|1227-61-8|Mefexadyne|Mefaxadyne|N-[2-(diethylamino)ethyl]-2-(4-methoxyphenoxy)acetamide|Acetamide, N-(2-(diethylamino)ethyl)-2-(4-methoxyphenoxy)-|N-(2-(Diethylamino)ethyl)-2-(p-methoxyphenoxy)acetamide|Mephexamide|Mexephenamide|84FP05

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

mefexamide | Timodyne | 1227-61-8 | Mefexadyne | Mefaxadyne | N-[2-(diethylamino)ethyl]-2-(4-methoxyphenoxy)acetamide | Acetamide, N-(2-(diethylamino)ethyl)-2-(4-methoxyphenoxy)- | N-(2-(Diethylamino)ethyl)-2-(p-methoxyphenoxy)acetamide | Mephexamide | Mexephenamide | 84FP05

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C

Verschickt in

Wet ice

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

Reinheit

≥98%

Namen und Kennungen

• Kanonisches Lächeln: CCN(CC)CCNC(=O)COC1=CC=C(C=C1)OC
• IUPAC Name: N-[2-(diethylamino)ethyl]-2-(4-methoxyphenoxy)acetamide
• InChIKey: HUNIPYLVUPMFCZ-UHFFFAOYSA-N
• INCHI: 1S/C15H24N2O3/c1-4-17(5-2)11-10-16-15(18)12-20-14-8-6-13(19-3)7-9-14/h6-9H,4-5,10-12H2,1-3H3,(H,16,18)
• Isomere SMILES: CCN(CC)CCNC(=O)COC1=CC=C(C=C1)OC
• Molekulargewicht: 316.82
• Reaxy-Rn: 2219009
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2219009&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenol ethers
      • Subclass Anisoles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenol ethers
• Subclass: Anisoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Anisoles
• Alternative Parents: Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Trialkylamines Propargyl-type 1,3-dipolar organic compounds Carboximidic acids Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Tertiary amine - Tertiary aliphatic amine - Carboximidic acid - Carboximidic acid derivative - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
• 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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CYP1A2 Tchem Cytochrome P450 1A2 (26471 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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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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GNAS Tbio Guanine nucleotide-binding protein G(s), subunit alpha (103405 Activities)

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ampC Beta-lactamase AmpC (62480 Activities)

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Hdac6 Histone deacetylase 6 (222 Activities)

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Plasmodium falciparum (966862 Activities)

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ffp 4'-phosphopantetheinyl transferase ffp (24982 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 280.360 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 280.179 Da
• Monoisotopic Mass: 280.179 Da
• Topological Polar Surface Area: 50.800 Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 262.000
• 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