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Fipexide hydrochloride

CAT: 0957-S6478-25mgSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0957-S6478-25mgSize:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
34161-23-4
Target
CAMP
Applications
GPCR & G Protein
Smiles
C1CN (CCN1CC2=CC3=C (C=C2) OCO3) C (=O) COC4=CC=C (C=C4) Cl.Cl
Molecular Formula
C20H22Cl2N2O4
Additionnal Information
Fipexide (hydrochloride) is a psychoactive drug of the piperazine class.
Storage Conditions
3 years -20°C powder

Chemical Information

Fipexide hydrochloride
CAS Number34161-23-4
PubChem CID161803
IUPAC Name1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(4-chlorophenoxy)ethanone;hydrochloride
Molecular FormulaC20H22Cl2N2O4
Molecular Weight425.3
Topological Polar Surface Area51.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity492
SMILES
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)COC4=CC=C(C=C4)Cl.Cl
InChI
InChI=1S/C20H21ClN2O4.ClH/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18;/h1-6,11H,7-10,12-14H2;1H
InChIKey
MVOWQBJZZKOQNU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fipexide hydrochloride
CAS: 34161-23-4
CID: 161803
Formula: C20H22Cl2N2O4
MW: 425.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight425.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass424.0956626
Monoisotopic Mass424.0956626
Topological Polar Surface Area51.2 Ų
Heavy Atom Count28
Formal Charge0
Complexity492
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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