7-{2-[2-(dimethylamino)ethoxy]ethoxy}-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine

7-{2-[2-(dimethylamino)ethoxy]ethoxy}-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine

CAS: 1238673-32-9

Formula: C27H45N7O3

SMILES: COC1=CC2=C(NC3CCN(C)CC3)N=C(N=C2C=C1OCCOCCN(C)C)N1CCCN(C)CC1

IUPAC: 7-{2-[2-(dimethylamino)ethoxy]ethoxy}-6-methoxy-2-(4-methyl-1,4-diazepan-1-yl)-N-(1-methylpiperidin-4-yl)quinazolin-4-amine

InChI: InChI=1S/C27H45N7O3/c1-31(2)15-16-36-17-18-37-25-20-23-22(19-24(25)35-5)26(28-21-7-11-33(4)12-8-21)30-27(29-23)34-10-6-9-32(3)13-14-34/h19-21H,6-18H2,1-5H3,(H,28,29,30)

Composition: C (62.88%), H (8.80%), N (19.01%), O (9.31%)

Molar Mass: 515.703

Atom Count: 82

Heavy Atom Count: 37

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	515.358388337
Formal Charge	0
FSP3	0.7
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
InChIKey	AULLUGALUBVBDD-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	152.04
Topological Polar Surface Area	78.46
Polarizability	58.47
Ring Count	4
Rotatable Bond Count	11

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	1238673-32-9		$62.68-$440.29$62.68$96.31$440.29