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(+) -Donepezil

CAT: 0931-T70697-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T70697-01Size:25 mg
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CAS Number
142698-19-9
Target
Others, Cholinesterase (ChE)
Related Pathways
Others, Neuroscience
Bioactivity
(+) -Donepezil is an isomer of Donepezil -- a nootropic acting as an inhibitor of acetylcholinesterase.
Smiles
O=C1C=2C(=CC(OC)=C(OC)C2)C[C@H]1CC3CCN(CC4=CC=CC=C4)CC3
Molecular Formula
C24H29NO3
Molecular Weight
379.49
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(R)-donepezil

(R)-donepezil is a 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxyindan-1-one that has R configuration. It is a conjugate base of a (R)-donepezil(1+). It is an enantiomer of a (S)-donepezil.

CAS Number142698-19-9
PubChem CID1150567
IUPAC Name(2R)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydroinden-1-one
Molecular FormulaC24H29NO3
Molecular Weight379.5
XLogP4.3
Topological Polar Surface Area38.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count28
Formal Charge0
Complexity510
SMILES
COC1=C(C=C2C(=C1)C[C@H](C2=O)CC3CCN(CC3)CC4=CC=CC=C4)OC
InChI
InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3/t20-/m1/s1
InChIKey
ADEBPBSSDYVVLD-HXUWFJFHSA-N
Chemical Structure
2D Structure
2D structure of (R)-donepezil
CAS: 142698-19-9
CID: 1150567
Formula: C24H29NO3
MW: 379.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight379.5
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass379.21474379
Monoisotopic Mass379.21474379
Topological Polar Surface Area38.8 Ų
Heavy Atom Count28
Formal Charge0
Complexity510
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes