192231-16-6,MFCD00952087
Catalog No.:AA002FOX

192231-16-6 | Pyridine, 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-, (2Z)-2-butenedioate (1:1)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
≥98%(HPLC)
in stock  
$297.00   $208.00
- +
10mg
≥98%(HPLC)
in stock  
$427.00   $299.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002FOX
Chemical Name:
Pyridine, 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-, (2Z)-2-butenedioate (1:1)
CAS Number:
192231-16-6
Molecular Formula:
C16H18N2O4
Molecular Weight:
302.3251
MDL Number:
MFCD00952087
SMILES:
OC(=O)/C=C\C(=O)O.C#Cc1cncc(c1)[C@@H]1CCCN1C
Properties
Computed Properties
 
Complexity:
359  
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
1  
Formal Charge:
0  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Literature

Title: Enantioselective, palladium-catalyzed α-arylation of N-Boc pyrrolidine: in situ react IR spectroscopic monitoring, scope, and synthetic applications.

Journal: The Journal of organic chemistry 20110805

Title: Pharmacological characterization of (S)-(2)-5-ethynyl-3-(1-methyl-2-pyrrolidinyl)pyridine HCl (SIB-1508Y, Altinicline), a novel nicotinic acetylcholine receptor agonist.

Journal: Brain research 20081009

Title: Expedient five-step synthesis of SIB-1508Y from natural nicotine.

Journal: The Journal of organic chemistry 20061027

Title: Randomized placebo-controlled study of the nicotinic agonist SIB-1508Y in Parkinson disease.

Journal: Neurology 20060214

Title: Reversal of a vigilance decrement in the aged rat by subtype-selective nicotinic ligands.

Journal: Neuropsychopharmacology : official publication of the American College of Neuropsychopharmacology 20030501

Title: Evidence that nicotinic alpha(7) receptors are not involved in the hyperlocomotor and rewarding effects of nicotine.

Journal: The Journal of pharmacology and experimental therapeutics 20000901

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SDS
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Tags:192231-16-6 Molecular Formula|192231-16-6 MDL|192231-16-6 SMILES|192231-16-6 Pyridine, 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-, (2Z)-2-butenedioate (1:1)
Catalog No.: AA002FOX
192231-16-6,MFCD00952087
192231-16-6 | Pyridine, 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-, (2Z)-2-butenedioate (1:1)
Pack Size: 5mg
Purity: ≥98%(HPLC)
in stock
$297.00 $208.00
Pack Size: 10mg
Purity: ≥98%(HPLC)
in stock
$427.00 $299.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA002FOX
Chemical Name: Pyridine, 3-ethynyl-5-[(2S)-1-methyl-2-pyrrolidinyl]-, (2Z)-2-butenedioate (1:1)
CAS Number: 192231-16-6
Molecular Formula: C16H18N2O4
Molecular Weight: 302.3251
MDL Number: MFCD00952087
SMILES: OC(=O)/C=C\C(=O)O.C#Cc1cncc(c1)[C@@H]1CCCN1C
Properties
Complexity: 359  
Covalently-Bonded Unit Count: 2  
Defined Atom Stereocenter Count: 1  
Defined Bond Stereocenter Count: 1  
Formal Charge: 0  
Heavy Atom Count: 22  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Literature fold

Title: Enantioselective, palladium-catalyzed α-arylation of N-Boc pyrrolidine: in situ react IR spectroscopic monitoring, scope, and synthetic applications.

Journal: The Journal of organic chemistry20110805

Title: Pharmacological characterization of (S)-(2)-5-ethynyl-3-(1-methyl-2-pyrrolidinyl)pyridine HCl (SIB-1508Y, Altinicline), a novel nicotinic acetylcholine receptor agonist.

Journal: Brain research20081009

Title: Expedient five-step synthesis of SIB-1508Y from natural nicotine.

Journal: The Journal of organic chemistry20061027

Title: Randomized placebo-controlled study of the nicotinic agonist SIB-1508Y in Parkinson disease.

Journal: Neurology20060214

Title: Reversal of a vigilance decrement in the aged rat by subtype-selective nicotinic ligands.

Journal: Neuropsychopharmacology : official publication of the American College of Neuropsychopharmacology20030501

Title: Evidence that nicotinic alpha(7) receptors are not involved in the hyperlocomotor and rewarding effects of nicotine.

Journal: The Journal of pharmacology and experimental therapeutics20000901

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