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(2R,3S) -E1R

CAT: 0931-T10094-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T10094-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1424832-60-9
Target
Sigma receptor, Others
Related Pathways
Others, GPCR/G Protein
Bioactivity
(2R,3S) -E1R (Compound 2c) is an enantiomer of E1R. (2R,3R) -E1R is a sigma-1 receptor positive allosteric modulator for treating cognition and memory disorders.
Smiles
C[C@@H]1[C@@H](CC(=O)N1CC(N)=O)c1ccccc1
Molecular Formula
C13H16N2O2
Molecular Weight
232.28
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(4S,5R)-2-Oxo-4beta-phenyl-5beta-methylpyrrolidine-1-acetamide
CAS Number1424832-60-9
PubChem CID71659350
IUPAC Name2-[(2R,3S)-2-methyl-5-oxo-3-phenylpyrrolidin-1-yl]acetamide
Molecular FormulaC13H16N2O2
Molecular Weight232.28
XLogP0.6
Topological Polar Surface Area63.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity311
SMILES
C[C@@H]1[C@@H](CC(=O)N1CC(=O)N)C2=CC=CC=C2
InChI
InChI=1S/C13H16N2O2/c1-9-11(10-5-3-2-4-6-10)7-13(17)15(9)8-12(14)16/h2-6,9,11H,7-8H2,1H3,(H2,14,16)/t9-,11-/m1/s1
InChIKey
ZTGRWYMPQCQTHD-MWLCHTKSSA-N
Chemical Structure
2D Structure
2D structure of (4S,5R)-2-Oxo-4beta-phenyl-5beta-methylpyrrolidine-1-acetamide
CAS: 1424832-60-9
CID: 71659350
Formula: C13H16N2O2
MW: 232.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight232.28
XLogP30.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass232.121177757
Monoisotopic Mass232.121177757
Topological Polar Surface Area63.4 Ų
Heavy Atom Count17
Formal Charge0
Complexity311
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

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