(S)-(-)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole - ≥98% , CAS No.106092-09-5

CAS: 106092-09-5 Cat. No.: D124073 Peso molecular: 169.25 Número EC: 600-715-3

GRADE & PURITY ≥98%

Synonyms

AC-1609 | (S)-N-Despropyl Pramipexole | DTXSID00893656 | EN300-208203 | 2-(Tributylstannyl)pyrimidine, 95% | SCHEMBL306889 | BP-11266 | (S)-4,5,6,7-tetrahydrobenzo[d]thiazole-2,6-diamine;(S)-2,6-Diamino-4,5,6,7-tetrahydrobenzothiazole | (6S)-2,6 diamino-4

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Descripción general

It is a (S)-Pramipexole intermediate. Acts as a dopamine autoreceptor agonist.
An intermediate and dopamine autoreceptor agonist.

Specifications

Sinónimos

AC-1609 | (S)-N-Despropyl Pramipexole | DTXSID00893656 | EN300-208203 | 2-(Tributylstannyl)pyrimidine, 95% | SCHEMBL306889 | BP-11266 | (S)-4, 5, 6, 7-tetrahydrobenzo[d]thiazole-2, 6-diamine;(S)-2, 6-Diamino-4, 5, 6, 7-tetrahydrobenzothiazole | (6S)-2, 6 diamino-4

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504766511
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766511
• Sonrisas canónicas: C1CC2=C(CC1N)SC(=N2)N
• IUPAC Name: (6S)-4,5,6,7-tetrahydro-1,3-benzothiazole-2,6-diamine
• InChIKey: DRRYZHHKWSHHFT-BYPYZUCNSA-N
• INCHI: 1S/C7H11N3S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h4H,1-3,8H2,(H2,9,10)/t4-/m0/s1
• Isómeros SMILES: C1CC2=C(C[C@H]1N)SC(=N2)N
• WGK Alemania: 3
• CAS alternativo: 106092-09-5
• Peso molecular: 169.25
• Reaxy-Rn: 6477894
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6477894&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Clase Organonitrogen compounds
      • Subclass Amines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Clase: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aralkylamines
• Alternative Parents: 2-amino-1,3-thiazoles Heteroaromatic compounds Azacyclic compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Aralkylamine - 1,3-thiazol-2-amine - Heteroaromatic compound - Thiazole - Azole - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Primary amine - Primary aliphatic amine - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl 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

Propiedades químicas y físicas

• Solubilidad: Soluble in Dimethyl Sulfoxide and Methanol
• Sensibilidad: Heat & Moisture & Light sensitive
• Rotación específica [α]: -96° (C=1,MeOH)
• Punto de fusión (°C): 229 °C
• Peso molecular: 169.250 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 169.067 Da
• Monoisotopic Mass: 169.067 Da
• Topological Polar Surface Area: 93.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 153.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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