CAS 6363-57-1

8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, hydrochloride (1:1), (1R,2S,3S,5S)-

Description:

8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, hydrochloride (1:1), (1R,2S,3S,5S)- is a complex organic compound characterized by its bicyclic structure, which includes a nitrogen atom in the ring, contributing to its classification as an azabicyclic compound. The presence of a carboxylic acid moiety indicates potential acidic properties, while the methyl ester suggests it can undergo hydrolysis to release the corresponding acid. The benzoyloxy group enhances its lipophilicity, potentially influencing its solubility and biological activity. The specific stereochemistry (1R,2S,3S,5S) indicates that the compound has multiple chiral centers, which can significantly affect its pharmacological properties and interactions with biological systems. As a hydrochloride salt, it is likely to be more soluble in water compared to its free base form, making it suitable for various applications, including medicinal chemistry. Overall, this compound's unique structural features and functional groups suggest potential utility in pharmaceutical development, particularly in the design of drugs targeting the central nervous system.

Formula: C₁₇H₂₁NO₄·ClH

InChI: InChI=1S/C17H21NO4.ClH/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11;/h3-7,12-15H,8-10H2,1-2H3;1H/t12-,13+,14-,15-;/m0./s1

InChI key: InChIKey=PIQVDUKEQYOJNR-UOIZBMALSA-N

SMILES: C(OC)(=O)[C@H]1[C@@]2(N(C)[C@](C[C@@H]1OC(=O)C3=CC=CC=C3)(CC2)[H])[H].Cl

Synonyms:

• 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, hydrochloride (1:1), (1R,2S,3S,5S)-
• 1αH,5αH-Tropane-2α-carboxylic acid, 3β-hydroxy-, methyl ester, benzoate (ester), hydrochloride
• 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, hydrochloride, [1R-(2-endo,3-exo)]-
• 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, methyl ester, hydrochloride, (1R,2S,3S,5S)-
• Pseudococaine hydrochloride

Pseudococaine Hydrochloride

Controlled Product

CAS: 6363-57-1

Applications Pseudococaine Hydrochloride, is a derivative of Cocaine (C633500). It is less potent in Inhibiting the dopamine, norepinephrine, and serotonin transporters.
Not a dangerous good if item is equal to or less than 1g/ml and there is less than 100g/ml in the package
References Komiskey, H. et al.: Life Sciences, 21, 1117 (1977), Blakely, R.D., et al.: Curr. Opin. Neurobiol., 10, 328 (2000), Cowell, R. M., et al.: Eur. J. Pharmacol., 389, 59 (2000), Fleckenstein, A.E., Eur. J. Pharmacol., 406, 1 (2000), Torres, G.E., et al.: Nat. Rev. Neurosci., 4, 13 (2003),

Formula: C₁₇H₂₂ClNO₄

Color and Shape: Neat

Molecular weight: 339.81

Ref: TR-P839515

Pseudococaine Hydrochloride-D3

Controlled Product

CAS: 6363-57-1

Formula: C₁₇H₁₈D₃NO₄•HCl

Color and Shape: Neat

Molecular weight: 342.84

Ref: TR-P839517

Pseudococaine hydrochloride

Controlled Product

CAS: 6363-57-1

Please enquire for more information about Pseudococaine hydrochloride including the price, delivery time and more detailed product information at the technical inquiry form on this page

Formula: C₁₇H₂₂ClNO₄

Purity: Min. 95%

Molecular weight: 339.8 g/mol

Ref: 3D-GAA36357