7-(benzyloxy)-N-(4-bromo-2-fluorophenyl)-6-methoxyquinazolin-4-amine

7-(benzyloxy)-N-(4-bromo-2-fluorophenyl)-6-methoxyquinazolin-4-amine

CAS: 768350-54-5

Formula: C22H17BrFN3O2

SMILES: COC1=CC2=C(NC3=CC=C(Br)C=C3F)N=CN=C2C=C1OCC1=CC=CC=C1

IUPAC: 7-(benzyloxy)-N-(4-bromo-2-fluorophenyl)-6-methoxyquinazolin-4-amine

InChI: InChI=1S/C22H17BrFN3O2/c1-28-20-10-16-19(11-21(20)29-12-14-5-3-2-4-6-14)25-13-26-22(16)27-18-8-7-15(23)9-17(18)24/h2-11,13H,12H2,1H3,(H,25,26,27)

Composition: C (58.16%), H (3.77%), Br (17.59%), F (4.18%), N (9.25%), O (7.04%)

Molar Mass: 454.299

Atom Count: 46

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	4
Asymmetric Atom Count	0
Exact Mass	453.048818
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	UPEHYJHYPMGWJC-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	112.98
Topological Polar Surface Area	56.27
Polarizability	43.77
Ring Count	4
Rotatable Bond Count	6

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	768350-54-5		$157.63-$244.63$157.63$244.63