(+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl
TL;DR: (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl (CAS 68322-05-4) is a chemical compound with molecular formula C14H20ClNO2S and molecular weight 301.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 8-methyl-2-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate;hydrochloride
Also Known As: (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl, 8-Azabicyclo(3.2.1)octane-3-carboxylic acid, 8-methyl-2-(2-thienyl)-, methyl ester, hydrochloride, (exo,exo)-(+-)-, methyl 8-methyl-4-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate hydrochloride, (+)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl, Methyl 8-methyl-2-(thiophen-2-yl)-8-azabicyclo[3.2.1]octane-3-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C14H20ClNO2S |
|---|---|
| Molecular Weight | 301.09 g/mol |
| LogP | 2.9092 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.09033 |
| Heavy Atoms | 19 |
| Complexity | 436.66418 |
Chemical Identifiers
| CAS Number | 68322-05-4 |
|---|---|
| SMILES | CN1C2CCC1C(C(C2)C(=O)OC)C3=CC=CS3.Cl |
Product Overview
(+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl (CAS 68322-05-4), with molecular formula C14H20ClNO2S and molecular weight 301.09 g/mol. IUPAC: methyl 8-methyl-2-thiophen-2-yl-8-azabicyclo[3.2.1]octane-3-carboxylate;hydrochloride.
Chemical Property Profile of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl
Property Insights of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl
The XLogP value of 2.9092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl. With a topological polar surface area (TPSA) of 29.54 Ų, (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl?
The CAS number of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl is 68322-05-4.
What is the molecular formula of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl?
The molecular formula of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl is C14H20ClNO2S.
What is the molecular weight of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl?
The molecular weight of (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl is 301.09 g/mol.
Where can I buy (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl?
You can request a quote for (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl?
Yes, KEHONG BIO provides custom synthesis services for (+-)-Methyl (1RS-exo,exo)-8-methyl-2-(2-thienyl)-8-azabicyclo(3.2.1)octane-3-carboxylate HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.