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Solpecainol

CAT: 0804-HY-164663-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-164663-02Size:5 mg
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Description
Solpecainol is an antiarrhythrmic compound. Solpecainol is a polarisation inhibitor[1].
CAS Number
155321-96-3
UNSPSC
12352005
Target
Others
Type
Reference compound
Related Pathways
Others
Field of Research
Cardiovascular Disease
Assay Protocol
https://www.medchemexpress.com/solpecainol.html
Smiles
C[C@H](COC1=CC=CC=C1)N[C@H](CO)[C@H](C2=CC=CC=C2)O
Molecular Formula
C18H23NO3
Molecular Weight
301.38
References & Citations
[1]Ranade, et al. Section Review: Cardiovascular & Renal: Developments in antiarrhythmic drugs: An overview. Expert Opinion on Investigational Drugs, 4 (11), 1101–1128. 1995.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

1,3-Propanediol, 2-[(1-methyl-2-phenoxyethyl)amino]-1-phenyl-, [1R*,2S*(S*)]-
CAS Number155321-96-3
PubChem CID76960526
IUPAC Name(1S,2R)-2-[[(2R)-1-phenoxypropan-2-yl]amino]-1-phenylpropane-1,3-diol
Molecular FormulaC18H23NO3
Molecular Weight301.4
XLogP2.1
Topological Polar Surface Area61.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count22
Formal Charge0
Complexity288
SMILES
C[C@H](COC1=CC=CC=C1)N[C@H](CO)[C@H](C2=CC=CC=C2)O
InChI
InChI=1S/C18H23NO3/c1-14(13-22-16-10-6-3-7-11-16)19-17(12-20)18(21)15-8-4-2-5-9-15/h2-11,14,17-21H,12-13H2,1H3/t14-,17-,18+/m1/s1
InChIKey
DQAFKLGCFBLEOM-OLMNPRSZSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Propanediol, 2-[(1-methyl-2-phenoxyethyl)amino]-1-phenyl-, [1R*,2S*(S*)]-
CAS: 155321-96-3
CID: 76960526
Formula: C18H23NO3
MW: 301.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight301.4
XLogP32.1
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass301.16779360
Monoisotopic Mass301.16779360
Topological Polar Surface Area61.7 Ų
Heavy Atom Count22
Formal Charge0
Complexity288
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
T68143-01Solpecainol

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