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

Base Information

Chemical Name:N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine
CAS No.:189290-58-2
Molecular Formula:C₁₆H₁₄IN₃O₂
Molecular Weight:407.211
Hs Code.:
DSSTox Substance ID:DTXSID10877962
Nikkaji Number:J967.244C
Wikidata:Q82859873
Pharos Ligand ID:7F4W1PLBMXXP
ChEMBL ID:CHEMBL96065
Mol file:189290-58-2.mol

Synonyms:189290-58-2;AG-1557;N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine;AG1557;4-Quinazolinamine, N-(3-iodophenyl)-6,7-dimethoxy-;CHEMBL96065;N-(3-Iodophenyl)-6,7-dimethoxy-4-quinazolinamine;BDBM3533;SCHEMBL7123822;DTXSID10877962;BCP23680;EX-A3014;MFCD28902185;AKOS026750320;AG 1557;NCGC00402317-01;NCGC00402317-02;AC-35894;HY-12806;MS-26985;CS-0012527;S0151;F11460;N-(3-Iodophenyl)-6,7-dimethoxyquinazoline-4-amine;N-(3-IODOPHYENYL)-6,7-DIMETHOXYOXY-4-QUINAZOLINA

Suppliers and Price of N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

DC Chemicals
AG-1557 >98%
100 mg
$ 500.00

DC Chemicals
AG-1557 >98%
1 g
$ 1600.00

DC Chemicals
AG-1557 >98%
250 mg
$ 850.00

Crysdot
N-(3-Iodophenyl)-6,7-dimethoxyquinazolin-4-amine 95+%
1g
$ 660.00

Chemenu
N-(3-Iodophenyl)-6,7-dimethoxyquinazolin-4-amine 95%
1g
$ 617.00

Cayman Chemical
AG-1557 ≥95%
25mg
$ 266.00

Cayman Chemical
AG-1557 ≥95%
50mg
$ 472.00

Cayman Chemical
AG-1557 ≥95%
10mg
$ 112.00

Cayman Chemical
AG-1557 ≥95%
5mg
$ 59.00

ApexBio Technology
AG-1557
10mg
$ 154.00

Total 17 raw suppliers

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

Chemical Property:

Boiling Point:492.9±45.0 °C(Predicted)
PKA:5.54±0.30(Predicted)
PSA：56.27000
Density:1.654±0.06 g/cm3(Predicted)
LogP:4.06820
Solubility.:≤0.5mg/ml in ethanol;1.5mg/ml in DMSO;1mg/ml in dimethyl formamide
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:407.01307
Heavy Atom Count:22
Complexity:360

Purity/Quality:

99%, ^*data from raw suppliers

AG-1557 >98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=CC=C3)I)OC
Description AG-1557 is an inhibitor of epidermal growth factor receptor (EGFR) tyrosine kinase with a pIC50 value of 8.194.

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

There total 3 articles about N-(3-iodophenyl)-6,7-dimethoxyquinazolin-4-amine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 100.0%

: 626-01-7
3-Iodoaniline

: 13790-39-1
6,7-dimethoxy-4-chloroquinazoline

: 189290-58-2
4-(3'-iodophenyl)-amino-6,7-dimethoxyquinazoline

Guidance literature:: With isopropyl alcohol; Heating;
DOI:10.1016/j.tetlet.2006.02.043

Reference yield:

: 13794-72-4
6,7-dimethoxy quinazolin-4-one

: 189290-58-2
4-(3'-iodophenyl)-amino-6,7-dimethoxyquinazoline

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / POCl₃; diisopropylethylamine / toluene / Heating

2: 100 percent / isopropanol / Heating

With N-ethyl-N,N-diisopropylamine; isopropyl alcohol; trichlorophosphate; In toluene;
DOI:10.1016/j.tetlet.2006.02.043

Reference yield:

: 26759-46-6
methyl 2-amino-4,5-dimethoxybenzoate

: 189290-58-2
4-(3'-iodophenyl)-amino-6,7-dimethoxyquinazoline

Guidance literature:: Multi-step reaction with 3 steps

1: 87 percent / 190 °C

2: 93 percent / POCl₃; diisopropylethylamine / toluene / Heating

3: 100 percent / isopropanol / Heating

With N-ethyl-N,N-diisopropylamine; isopropyl alcohol; trichlorophosphate; In toluene;
DOI:10.1016/j.tetlet.2006.02.043