N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine

ChemicalBook > CAS DataBase List > N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine

N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine

Product Name: N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine
CAS No.: 189290-58-2
Chemical Name: N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine
Synonyms: AG-1557;AG 1557;AG1557;N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine;4-Quinazolinamine, N-(3-iodophenyl)-6,7-dimethoxy-;AG1557,EGFR,Epidermal growth factor receptor,ErbB-1,Inhibitor,inhibit,HER1
CBNumber: CB32738423
Molecular Formula: C16H14IN3O2
Formula Weight: 407.21
MOL File: 189290-58-2.mol

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N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine Property

Boiling point:: 492.9±45.0 °C(Predicted)
Density: 1.654±0.06 g/cm3(Predicted)
storage temp.: Store at -20°C
solubility: ≤0.5mg/ml in ethanol;1.5mg/ml in DMSO;1mg/ml in dimethyl formamide
form: crystalline solid
pka: 5.54±0.30(Predicted)

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word: Warning

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N-Bromosuccinimide Price

Cayman Chemical

Product number: 17989
Product name: AG-1557
Purity: ≥95%
Packaging: 5mg
Price: $73
Updated: 2024/03/01

Cayman Chemical

Product number: 17989
Product name: AG-1557
Purity: ≥95%
Packaging: 10mg
Price: $138
Updated: 2024/03/01

Cayman Chemical

Product number: 17989
Product name: AG-1557
Purity: ≥95%
Packaging: 25mg
Price: $324
Updated: 2024/03/01

Cayman Chemical

Product number: 17989
Product name: AG-1557
Purity: ≥95%
Packaging: 50mg
Price: $575
Updated: 2024/03/01

ApexBio Technology

Product number: C5417
Product name: AG-1557
Packaging: 25mg
Price: $369
Updated: 2021/12/16

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N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine Chemical Properties,Usage,Production

Description

AG-1557 is an inhibitor of epidermal growth factor receptor (EGFR) tyrosine kinase with a pIC₅₀ value of 8.194.

Uses

AG-1557 is a specific and ATP competitive inhibitor of epidermal growth factor receptor (EGFR) tyrosine kinase.

in vitro

a pharmacophore model was developed using a dataset of 77 chemically diverse egfr inhibitors including ag-1557 using phase. statistically valid three dimensional quantitative structure activity relationship (3d-qsar) equations were generated. docking of the probable hits into the crystal structure of egfr was used as a second filter. calculation of adme properties of the probable hits arising out of docking further reduced the number of hits. the pharmacophore results indicated that the presence of two aromatic ring features, one acceptor feature, one donor feature and one hydrophobic feature were necessary for potent inhibitory activity. the generated pharmacophore resulted in a 3d-qsar model, with a correlation coefficient r2 of 0.9905 and q2 of 0.8764. docking studies as a second filter reduced the hits to 8. application of drug-likeness as a third filter gave 6 leads. ag-1557 was screening as an inhibitor of egfr tyrosine kinase with a predicted pic50 value of 8.62, which was comparable with its experimental determined value of 8.194 [1].

References

[1] joshi, a. ,gadhwal, m., and joshi, u.j. indentification of potential novel egfr inhibitors using a combination of pharmacophore and docking methods. int. j. pharm. pharmaceut. sci. 7(6), (2015).

N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine Preparation Products And Raw materials

Raw materials

Preparation Products

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189290-58-2, N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amineRelated Search:

AG-1557

N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine

AG 1557;AG1557

4-Quinazolinamine, N-(3-iodophenyl)-6,7-dimethoxy-

AG1557,EGFR,Epidermal growth factor receptor,ErbB-1,Inhibitor,inhibit,HER1

189290-58-2

Inhibitors