Brassinazole - ≥90%(HPLC)(Mixed spin) , CAS No.224047-41-0

CAS: 224047-41-0 Cat. No.: B152405 Fórmula: C₁₈H₁₈ClN₃O Peso molecular: 327.81 Número EC: 678-200-8

CALIDAD & PUREZA ≥90%(HPLC)(Mixed spin)

Synonyms

BRZ|2,3-cs/ex-PinD|Sodium tetraborate (Na2B4O7)|4-(4-chlorophenyl)-2-phenyl-3-(1,2,4-triazol-1-yl)-2-butanol|(Rac)-Brassinazole|1H-1,2,4-Triazole-1-ethanol, beta-((4-chlorophenyl)methyl)-alpha-methyl-alpha-phenyl-|S(+)--Vigabatrin|Brassinazole|4-(4-Chloro-phenyl)-2-phenyl-3-[1,2,4]triazol-1-yl-butan-2-ol|1H-1,2,4-TRIAZOLE-1-ETHANOL, .BETA.-((4-CHLOROPHENYL)METHYL)-.ALPHA.-METHYL-.ALPHA.-PHENYL-|3-(4-Chlorophenyl)-1-methyl-1-phenyl-2-(1,2,4-triazol-1-yl)-1-propanol|4-(4-chlorophenyl)-2-phenyl-3-(1H-1,2,4-triazol-1-yl)butan-2-ol|1-[2-(4-Chlorophenyl)-1-(1-hydroxy-1-phenylethyl)ethyl]-1,2,4-triazole

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Brassinazole has been used in phenotype analyses to detect morphological changes in G-protein β subunit agb1 mutants.

Especificaciones

Sinónimos

BRZ | 2,3-cs/ex-PinD | Sodium tetraborate (Na2B4O7) | 4-(4-chlorophenyl)-2-phenyl-3-(1,2,4-triazol-1-yl)-2-butanol | (Rac)-Brassinazole | 1H-1,2,4-Triazole-1-ethanol, beta-((4-chlorophenyl)methyl)-alpha-methyl-alpha-phenyl- | S(+)--Vigabatrin | Brassinazole | 4-(4-Chloro-phenyl)-2-phenyl-3-[1,2,4]triazol-1-yl-butan-2-ol | 1H-1,2,4-TRIAZOL Show more

Especificaciones y pureza

≥90%(HPLC)(Mixed spin)

Mecanismos bioquímicos y fisiológicos

Brassinazole can induce dwarfing and morphological changes in Arabidopsis thaliana, which results in similarity with brassinol-deficient mutants. These changes were neutralized by brassinolide treatment, suggesting that brassinazole was responsible for br

Condiciones de almacenamiento de almacenamiento

Store at -20°C

Enviado en

Ice chest + Ice pads

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Pureza

≥90%(HPLC)(Mixed spin)

Nombres e identificadores

Pubchem Sid

488198900

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488198900

Sonrisas canónicas

CC(C1=CC=CC=C1)(C(CC2=CC=C(C=C2)Cl)N3C=NC=N3)O

IUPAC Name

4-(4-chlorophenyl)-2-phenyl-3-(1,2,4-triazol-1-yl)butan-2-ol

InChIKey

YULDTPKHZNKFEY-UHFFFAOYSA-N

INCHI

1S/C18H18ClN3O/c1-18(23,15-5-3-2-4-6-15)17(22-13-20-12-21-22)11-14-7-9-16(19)10-8-14/h2-10,12-13,17,23H,11H2,1H3

Isómeros SMILES

CC(C1=CC=CC=C1)(C(CC2=CC=C(C=C2)Cl)N3C=NC=N3)O

Peso molecular

327.81

Reaxy-Rn

8267246

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8267246&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Phenylpropanoids and polyketides
    • Clase Linear 1,3-diarylpropanoids

• Kingdom: Organic compounds
• Superclass: Phenylpropanoids and polyketides
• Clase: Linear 1,3-diarylpropanoids
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Linear 1,3-diarylpropanoids
• Alternative Parents: Amphetamines and derivatives Chlorobenzenes Aryl chlorides Triazoles Tertiary alcohols Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Linear 1,3-diarylpropanoid - Amphetamine or derivatives - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - 1,2,4-triazole - Tertiary alcohol - Azacycle - Organoheterocyclic compound - Organochloride - Organohalogen compound - Aromatic alcohol - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
• External Descriptors: tertiary alcohol - monochlorobenzenes - triazoles

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

Objetivos asociados (no humanos)

Oryza sativa (2923 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: 66 mg/mL(201.34 mM) in DMSO；4 mg/mL (12.20 mM) in Ethanol；Water（Insoluble ）
• Peso molecular: 327.800 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 327.114 Da
• Monoisotopic Mass: 327.114 Da
• Topological Polar Surface Area: 50.900 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 369.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1