Midodrine, Hydrochloride - ≥98% , CAS No.3092-17-9

CAS: 3092-17-9 Cat. No.: M348629 Summenformel: C₁₂H₁₈N₂O₄HCl Molekulargewicht: 290.75 EG-Nummer: 622-590-4

GRADE & PURITY ≥98%

Synonyms

HMS1922O03 | SR-05000001847-3 | (+/-)-2-AMINO-N-(beta-HYDROXY-2,5-DIMETHOXYPHENETHYL)ACETAMIDE MONOHYDROCHLORIDE | 2-Amino-N-(2-(2,5-dimethoxyphenyl)-2-hydroxyethyl)acetamide monohydrochloride | Hipertan | MIDODRINE HYDROCHLORIDE [MI] | ST 1085 HYDROCHLOR

Storage

Room temperature

Shipped In

Normal

Übersicht

Midodrine, Hydrochloride is a phenylalkanolamine derivative which has been found to be effective in the treatment of hypertensive conditions due to their long lasting, blood pressure increasing effects.

Specifications

Synonyme

HMS1922O03 | SR-05000001847-3 | (+/-)-2-AMINO-N-(beta-HYDROXY-2,5-DIMETHOXYPHENETHYL)ACETAMIDE MONOHYDROCHLORIDE | 2-Amino-N-(2-(2,5-dimethoxyphenyl)-2-hydroxyethyl)acetamide monohydrochloride | Hipertan | MIDODRINE HYDROCHLORIDE [MI] | ST 1085 HYDROCHLOR

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln

COC1=CC(=C(C=C1)OC)C(CNC(=O)CN)O.Cl

IUPAC Name

2-amino-N-[2-(2,5-dimethoxyphenyl)-2-hydroxyethyl]acetamide;hydrochloride

InChIKey

MGCQZNBCJBRZDT-UHFFFAOYSA-N

INCHI

1S/C12H18N2O4.ClH/c1-17-8-3-4-11(18-2)9(5-8)10(15)7-14-12(16)6-13;/h3-5,10,15H,6-7,13H2,1-2H3,(H,14,16);1H

Isomere SMILES

COC1=CC(=C(C=C1)OC)C(CNC(=O)CN)O.Cl

Molekulargewicht

290.75

Reaxy-Rn

6579688

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6579688&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives
            • Ebene7 Alpha amino acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acid amides
• Alternative Parents: Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Secondary carboxylic acid amides Secondary alcohols Organopnictogen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Alpha-amino acid amide - P-dimethoxybenzene - Dimethoxybenzene - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Ether - Alcohol - Primary amine - Aromatic alcohol - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrochloride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alpha amino acid amides. These are amide derivatives of alpha amino acids.
• 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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HepG2 (196354 Activities)

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ampC Beta-lactamase AmpC (62480 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 227-229°C (lit.)
• Molekulargewicht: 290.740 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 290.103 Da
• Monoisotopic Mass: 290.103 Da
• Topological Polar Surface Area: 93.800 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 262.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

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