4-Chloro-7-methoxy-6-quinazolinyl Acetate Hydrochloride - CAS 179688-54-1

Name: 4-Chloro-7-methoxy-6-quinazolinyl Acetate Hydrochloride
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB013596
Product Name:	4-Chloro-7-methoxy-6-quinazolinyl Acetate Hydrochloride
CAS:	179688-54-1
Synonyms:	acetic acid (4-chloro-7-methoxy-6-quinazolinyl) ester;hydrochloride; (4-chloro-7-methoxyquinazolin-6-yl) acetate;hydrochloride

Technical Data

IUPAC Name:	(4-chloro-7-methoxyquinazolin-6-yl) acetate;hydrochloride
Description:	4-Chloro-7-methoxy-6-quinazolinyl Acetate Hydrochloride (CAS# 179688-54-1) is a useful research chemical.
Molecular Weight:	289.11
Molecular Formula:	C11H10Cl2N2O3
Canonical SMILES:	CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)Cl)OC.Cl
InChI:	InChI=1S/C11H9ClN2O3.ClH/c1-6(15)17-10-3-7-8(4-9(10)16-2)13-5-14-11(7)12;/h3-5H,1-2H3;1H
InChI Key:	DSYIUUXIRMLRQU-UHFFFAOYSA-N
Boiling Point:	393.3 °C at 760 mmHg
MDL:	MFCD12761613
LogP:	3.01910

Publication Number	Title	Priority Date
WO-2020262998-A1	Novel quinazoline derivative having anti-tumor activity and pharmaceutical composition comprising same	20190626
KR-20210002012-A	Novel quinazoline derivatives with anti-tumor activity and pharmaceutical composition comprising the same	20190626
AU-2018353142-A1	Inhibitors of mutant EGFR family tyrosine-kinases	20171018
TW-201922726-A	Mutant epidermal growth factor receptor (EGFR) population of tyrosine kinase inhibitors	20171018
WO-2019079599-A1	MUTANT TYROSINE KINASE INHIBITORS OF THE EGFR FAMILY	20171018

Complexity:	290
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	288.0068476
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	288.0068476
Rotatable Bond Count:	3
Topological Polar Surface Area:	61.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0