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Dihexyverine HCl

CAT: 0931-T23998-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T23998-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5588-25-0
Target
Others
Related Pathways
Others
Bioactivity
Dihexyverine HCl is an antimuscarinic with effects similar to those of atropine.
Smiles
Cl.O=C(OCCN1CCCCC1)C2(CCCCC2)C3CCCCC3
Molecular Formula
C20H36ClNO2
Molecular Weight
357.96
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Dihexyverine Hydrochloride
CAS Number5588-25-0
PubChem CID5744890
IUPAC Name2-piperidin-1-ylethyl 1-cyclohexylcyclohexane-1-carboxylate;hydrochloride
Molecular FormulaC20H36ClNO2
Molecular Weight358.0
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity364
SMILES
C1CCC(CC1)C2(CCCCC2)C(=O)OCCN3CCCCC3.Cl
InChI
InChI=1S/C20H35NO2.ClH/c22-19(23-17-16-21-14-8-3-9-15-21)20(12-6-2-7-13-20)18-10-4-1-5-11-18;/h18H,1-17H2;1H
InChIKey
AQFATCCHOXBYNK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dihexyverine Hydrochloride
CAS: 5588-25-0
CID: 5744890
Formula: C20H36ClNO2
MW: 358.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight358.0
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass357.2434571
Monoisotopic Mass357.2434571
Topological Polar Surface Area29.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity364
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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Alternative Products

CatalogName
446947-01Dihexyverine Hydrochloride
GTR19200360-01Dihexyverine HCl
HY-124515Dihexyverine (hydrochloride)

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