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Piperidolate

CAT: 0931-T7405-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T7405-01Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
82-98-4
Target
AChR
Related Pathways
Neuroscience
Purity
0.9845
Bioactivity
Piperidolate inhibits intestinal cramp induced by acetylcholine
Smiles
CCN1CCCC(C1)OC(=O)C(c1ccccc1)c1ccccc1
Molecular Formula
C21H25NO2
Molecular Weight
323.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Piperidolate

2,2-diphenylacetic acid (1-ethyl-3-piperidinyl) ester is a diarylmethane.

CAS Number82-98-4
PubChem CID4839
IUPAC Name(1-ethylpiperidin-3-yl) 2,2-diphenylacetate
Molecular FormulaC21H25NO2
Molecular Weight323.4
XLogP4.4
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity367
SMILES
CCN1CCCC(C1)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H25NO2/c1-2-22-15-9-14-19(16-22)24-21(23)20(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3-8,10-13,19-20H,2,9,14-16H2,1H3
InChIKey
KTHVBAZBLKXIHZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Piperidolate
CAS: 82-98-4
CID: 4839
Formula: C21H25NO2
MW: 323.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight323.4
XLogP34.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count6
Exact Mass323.188529040
Monoisotopic Mass323.188529040
Topological Polar Surface Area29.5 Ų
Heavy Atom Count24
Formal Charge0
Complexity367
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

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A18257-200Piperidolate 200mg
A18257-50Piperidolate 50mg
A18257-25Piperidolate 25mg
A18257-10Piperidolate 10mg
AR-P31860Piperidolate HCl
HY-B0962-01Piperidolate (hydrochloride)

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