AMT hydrochloride - ≥98% , CAS No.21463-31-0

CAS: 21463-31-0 Cat. No.: A287779 Formule: C₅H₁₀N₂S.HCl Poids moléculaire: 166.67

GRADE & PURITY ≥98%

Synonyms

SMR000326965 | EU-0100085 | CCG-221389 | J-014084 | 2-Amino-5,6-dihydro-6-methyl-4H-1,3-thiazine hydrochloride | NCGC00260770-01 | MLS000862202 | WAA46331 | AMTHYDROCHLORIDE | AMT hydrochloride | AMT (hydrochloride) | 6-methyl-5,6-dihydro-4H-1,3-thiazin-2

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Specifications

Synonymes

SMR000326965 | EU-0100085 | CCG-221389 | J-014084 | 2-Amino-5,6-dihydro-6-methyl-4H-1,3-thiazine hydrochloride | NCGC00260770-01 | MLS000862202 | WAA46331 | AMTHYDROCHLORIDE | AMT hydrochloride | AMT (hydrochloride) | 6-methyl-5,6-dihydro-4H-1,3-thiazin-2

Spécifications et pureté

≥98%

Mécanismes biochimiques et physiologiques

Potent, selective and reversible inhibitor of iNOS (IC50= 3.6 nM; approximately 30 and 40 times selective over nNOS and eNOS respectively).

Conditions de stockage de stockage

Store at -20°C,Desiccated

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Type d'action

INHIBITOR

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 528763100
• Sourires canoniques: CC1CCN=C(S1)N.Cl
• IUPAC Name: 6-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine;hydrochloride
• InChIKey: HVJCRMIQAMEJNM-UHFFFAOYSA-N
• INCHI: 1S/C5H10N2S.ClH/c1-4-2-3-7-5(6)8-4;/h4H,2-3H2,1H3,(H2,6,7);1H
• Isomères SMILES: CC1CCN=C(S1)N.Cl
• Poids moléculaire: 166.67
• Reaxy-Rn: 5390939
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5390939&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Thiazines
      • Subclass 1,3-thiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Thiazines
• Subclass: 1,3-thiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: 1,3-thiazines
• Alternative Parents: Isothioureas Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Meta-thiazine - Isothiourea - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrochloride - Organonitrogen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as 1,3-thiazines. These are organic compounds containing 1,3-thiazine, a six-member ring with a nitrogen and a sulfur atoms in ring positions 1 and 3 respectively, as well as two double bonds.
• 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

Cibles associées (humaines)

THRB Tclin Thyroid hormone receptor beta-1 (7926 Activities)

Discover Target: THRB

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

Discover Target: EHMT2

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BLM Tchem Bloom syndrome protein (4248 Activities)

Discover Target: BLM

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PMP22 Tbio Peripheral myelin protein 22 (699 Activities)

Discover Target: PMP22

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Cibles associées (non humaines)

RAW264.7 (28094 Activities)

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Solvent:water, Max Conc. mg/mL: None, Max Conc. mM: 10
• Poids moléculaire: 166.670 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 166.033 Da
• Monoisotopic Mass: 166.033 Da
• Topological Polar Surface Area: 63.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 111.000
• 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

XLogP3

Références

1. Chaoli Tang, Dachao Fu, Rujing Wang, Xiaoyu Zhang, Liman Wei, Mingjun Li, Chengpan Li, Qiao Cao, Xiangyu Chen.  (2024)  An Electrochemical Microfluidic System for On-site Continuous Monitoring of Soil Phosphate.  IEEE SENSORS JOURNAL,      [PMID:] [10.1109/JSEN.2023.3348807]