2-Amino-7-chloroquinazoline - CAS 190274-08-9

Catalog:	BB014710
Product Name:	2-Amino-7-chloroquinazoline
CAS:	190274-08-9
Synonyms:	7-chloro-2-quinazolinamine; 7-chloroquinazolin-2-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	7-chloroquinazolin-2-amine
Description:	2-Amino-7-chloroquinazoline (CAS# 190274-08-9) is a useful research chemical.
Molecular Weight:	179.61
Molecular Formula:	C8H6ClN3
Canonical SMILES:	C1=CC2=CN=C(N=C2C=C1Cl)N
InChI:	InChI=1S/C8H6ClN3/c9-6-2-1-5-4-11-8(10)12-7(5)3-6/h1-4H,(H2,10,11,12)
InChI Key:	YDOGZWNBUUUMPJ-UHFFFAOYSA-N
Boiling Point:	403.364 °C at 760 mmHg
Density:	1.446 g/cm³
LogP:	2.44660

Publication Number	Title	Priority Date
AU-2016340798-A1	Aminoisoxazoline compounds as agonists of alpha7-nicotinic acetylcholine receptors	20151020
CA-3002801-A1	Aminoisoxazoline compounds as agonists of alpha7-nicotinic acetylcholine receptors	20151020
EP-3365061-A1	Aminoisoxazoline compounds as agonists of alpha7-nicotinic acetylcholine receptors	20151020
JP-2018531262-A	Aminoisoxazoline compounds as agonists of Î±7-nicotinic acetylcholine receptors	20151020
US-2017247393-A1	Aminoisoxazoline Compounds as Agonists of Alpha7-Nicotinic Acetylcholine Receptors	20151020

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Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	179.0250249
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	179.0250249
Rotatable Bond Count:	0
Topological Polar Surface Area:	51.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4