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Anipamil

CAT: 0931-T14290-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T14290-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
83200-10-6
Target
Calcium Channel, Others
Related Pathways
Others, Membrane transporter/Ion channel, Metabolism
Bioactivity
Anipamil is a long-acting blocker of calcium channel, and for the treatment of cardiovascular disease.
Smiles
C(CCCN(CCC1=CC(OC)=CC=C1)C)(CCCCCCCCCCCC)(C#N)C2=CC(OC)=CC=C2
Molecular Formula
C34H52N2O2
Molecular Weight
520.79
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Anipamil

structure given in first source

CAS Number83200-10-6
PubChem CID54966
IUPAC Name2-(3-methoxyphenyl)-2-[3-[2-(3-methoxyphenyl)ethyl-methylamino]propyl]tetradecanenitrile
Molecular FormulaC34H52N2O2
Molecular Weight520.8
XLogP10.4
Topological Polar Surface Area45.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count21
Heavy Atom Count38
Formal Charge0
Complexity631
SMILES
CCCCCCCCCCCCC(CCCN(C)CCC1=CC(=CC=C1)OC)(C#N)C2=CC(=CC=C2)OC
InChI
InChI=1S/C34H52N2O2/c1-5-6-7-8-9-10-11-12-13-14-23-34(29-35,31-19-16-21-33(28-31)38-4)24-17-25-36(2)26-22-30-18-15-20-32(27-30)37-3/h15-16,18-21,27-28H,5-14,17,22-26H2,1-4H3
InChIKey
PHFDAOXXIZOUIX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Anipamil
CAS: 83200-10-6
CID: 54966
Formula: C34H52N2O2
MW: 520.8
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight520.8
XLogP310.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count21
Exact Mass520.40287891
Monoisotopic Mass520.40287891
Topological Polar Surface Area45.5 Ų
Heavy Atom Count38
Formal Charge0
Complexity631
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes