CAS 148741-30-4

(2E)-3-[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]-2-cyano-2-propenethioamide

Description:

The chemical substance known as (2E)-3-[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]-2-cyano-2-propenethioamide, with the CAS number 148741-30-4, is a synthetic compound characterized by its complex structure, which includes a cyano group, a thioamide functional group, and a hydroxyphenyl moiety. This compound features a conjugated system that contributes to its potential biological activity, particularly in the realm of pharmaceuticals and agrochemicals. The presence of bulky tert-butyl groups enhances its lipophilicity, which may influence its solubility and permeability in biological systems. Additionally, the hydroxy group can participate in hydrogen bonding, potentially affecting its reactivity and interaction with biological targets. The thioamide group may also impart unique chemical properties, such as increased stability under certain conditions. Overall, this compound's structural features suggest it may exhibit interesting pharmacological properties, warranting further investigation in medicinal chemistry and related fields.

Formula: C₁₈H₂₄N₂OS

InChI: InChI=1S/C18H24N2OS/c1-17(2,3)13-8-11(7-12(10-19)16(20)22)9-14(15(13)21)18(4,5)6/h7-9,21H,1-6H3,(H2,20,22)/b12-7+

InChI key: InChIKey=XRZYELWZLNAXGE-KPKJPENVSA-N

SMILES: C(C)(C)(C)C1=C(O)C(C(C)(C)C)=CC(/C=C(/C(N)=S)\C#N)=C1

Synonyms:

• (2E)-3-[3,5-Bis(1,1-dimethylethyl)-4-hydroxyphenyl]-2-cyano-2-propenethioamide
• (2E)-3-amino-2-[(3,5-di-tert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-3-sulfanylprop-2-enenitrile
• (3,5-Di-T-Butyl-4-Hydroxybenzylidene)Thiocyanoacetamide
• 2-Propenethioamide, 3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-2-cyano-, (2E)-
• 2-Propenethioamide, 3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-2-cyano-, (E)-
• Ag 879
• Alpha-Cyano-(3,5-Di-T-Butyl-4-Hydroxy)Thiocinnamide
• Alpha-Cyano-(3,5-Di-Tert-Butyl-4-Hydroxy)Thiocinnamamide
• Tyrphostin 879
• Α-Cyano-(3,5-Di-T-Butyl-4-Hydroxy)Thiocinnamide
• Tyrphostin AG 879

(2E)-2-Cyano-3-(3,5-di-tert-butyl-4-hydroxyphenyl)prop-2-enethioamide

CAS: 148741-30-4

Formula: C₁₈H₂₄N₂OS

Purity: 95%

Color and Shape: Solid

Molecular weight: 316.4610

Ref: IN-DA001L5Z

Tyrphostin Ag 879

CAS: 148741-30-4

Tyrphostin Ag 879

Purity: 95%

Molecular weight: 316.46g/mol

Ref: 54-OR1025802

Tyrphostin AG 879

CAS: 148741-30-4

Formula: C₁₈H₂₄N₂OS

Molecular weight: 316.50

Ref: 7W-GK3133

Tyrphostin AG 879

CAS: 148741-30-4

Tyrphostin AG 879

Purity: ≥98%

Molecular weight: 316.46g/mol

Ref: 54-BUP06442

Tyrphostin AG 879

CAS: 148741-30-4

Formula: C₁₈H₂₄N₂OS

Purity: >98.0%(HPLC)

Color and Shape: Light yellow to Yellow to Orange powder to crystal

Molecular weight: 316.46

Ref: 3B-T3696

Tyrphostin AG 879

CAS: 148741-30-4

Tyrphostin AG 879 (AG 879) effectively inhibits HER2/ErbB2 (IC50: 1 μM), 100- and 500-fold higher selective to ErbB2 than EGFR and PDGFR.

Formula: C₁₈H₂₄N₂OS

Purity: 99.05%

Color and Shape: Solid

Molecular weight: 316.46

Ref: TM-T6712