4-(piperazin-1-yl)quinazoline dihydrate dihydrochloride

4-(piperazin-1-yl)quinazoline dihydrate dihydrochloride

Formula: C12H20Cl2N4O2

SMILES: O.O.Cl.Cl.C1CN(CCN1)C1=NC=NC2=CC=CC=C12

IUPAC: 4-(piperazin-1-yl)quinazoline dihydrate dihydrochloride

InChI: InChI=1S/C12H14N4.2ClH.2H2O/c1-2-4-11-10(3-1)12(15-9-14-11)16-7-5-13-6-8-16;;;;/h1-4,9,13H,5-8H2;21H;21H2

Composition: C (44.59%), H (6.24%), Cl (21.94%), N (17.33%), O (9.90%)

Molar Mass: 323.22

Atom Count: 40

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	322.0963313
Formal Charge	0
FSP3	0.33
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	MQCSUJFGUBYJDZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.3
Topological Polar Surface Area	41.05
Polarizability	25.38
Ring Count	3
Rotatable Bond Count	1

Suppliers

ChemBridge Corp.

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<4 Days	C12H20Cl2N4O2		$152.95-$1,546.75$152.95$378.35$1,546.75