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Flunarizine 2HCl

CAT: 1568-C08220-25mgSize: 25 mgDry Ice: YesHazardous: No
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CAT#:1568-C08220-25mgSize:25 mg
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CAS Number
30484-77-6
Synonyms
KW-3149, R14950
Target
Calcium Channel
Applications
Neuronal Signaling
Smiles
C1CN (CCN1CC=CC2=CC=CC=C2) C (C3=CC=C (C=C3) F) C4=CC=C (C=C4) F.Cl.Cl
Molecular Formula
C26H26F2N2.2HCl
Additionnal Information
Flunarizine 2HCl (KW-3149, R14950) is a dihydrochloride salt form which is a calcium channel blocker with a Ki of 68 nM.
Storage Conditions
2 years -80 in solvent

Chemical Information

Flunarizine Hydrochloride

Flunarizine hydrochloride is a diarylmethane.

CAS Number30484-77-6
PubChem CID5282407
IUPAC Name1-[bis(4-fluorophenyl)methyl]-4-[(E)-3-phenylprop-2-enyl]piperazine;dihydrochloride
Molecular FormulaC26H28Cl2F2N2
Molecular Weight477.4
Topological Polar Surface Area6.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count32
Formal Charge0
Complexity487
SMILES
C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F.Cl.Cl
InChI
InChI=1S/C26H26F2N2.2ClH/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21;;/h1-15,26H,16-20H2;2*1H/b7-4+;;
InChIKey
RXKMOPXNWTYEHI-RDRKJGRWSA-N
Chemical Structure
2D Structure
2D structure of Flunarizine Hydrochloride
CAS: 30484-77-6
CID: 5282407
Formula: C26H28Cl2F2N2
MW: 477.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight477.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass476.1597606
Monoisotopic Mass476.1597606
Topological Polar Surface Area6.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity487
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes