N-(3-chloro-4-fluorophenyl)-6-(3-chloropropoxy)-7-methoxyquinazolin-4-amine


Chemical Name: N-(3-chloro-4-fluorophenyl)-6-(3-chloropropoxy)-7-methoxyquinazolin-4-amine
CAS Number: 912556-91-3
Product Number: AG00IGK6(AGN-PC-08S4KW)
Synonyms:
MDL No:
Molecular Formula: C18H16Cl2FN3O2
Molecular Weight: 396.2429

Identification/Properties


Computed Properties
Molecular Weight:
396.243g/mol
XLogP3:
5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
7
Exact Mass:
395.06g/mol
Monoisotopic Mass:
395.06g/mol
Topological Polar Surface Area:
56.3A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
437
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



The compound N-(3-Chloro-4-fluorophenyl)-6-(3-chloropropoxy)-7-methoxyquinazolin-4-amine has significant applications in chemical synthesis as a versatile building block. Due to its unique structure, it serves as a key intermediate in the synthesis of various pharmaceutical compounds and organic materials. With its substituted phenyl and quinazolin-4-amine moieties, this compound can participate in a wide range of reactions such as nucleophilic substitution, Suzuki coupling, and Heck reactions. Its functional groups enable precise modifications and derivatizations to tailor its properties for specific synthetic pathways, making it a valuable tool in the creation of novel molecules with potential biological activities. Its versatility and reactivity make it a valuable asset in the toolkit of synthetic chemists for the development of new compounds and materials.