1-(4-Methoxybenzyl)-3-acetoxynorcotinine
TL;DR: 1-(4-Methoxybenzyl)-3-acetoxynorcotinine (CAS 887406-83-9) is a chemical compound with molecular formula C19H20N2O4 and molecular weight 340.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(4-methoxyphenyl)methyl]-2-oxo-5-pyridin-3-ylpyrrolidin-3-yl] acetate
Also Known As: 1-(4-Methoxybenzyl)-3-acetoxynorcotinine, [1-[(4-methoxyphenyl)methyl]-2-oxo-5-pyridin-3-ylpyrrolidin-3-yl] acetate, 1-(4-Methoxybenzyl)-2-oxo-5-(pyridin-3-yl)pyrrolidin-3-yl acetate, 3-(Acetyloxy)-1-[(4-methoxyphenyl)methyl]-5-(3-pyridinyl)-2-pyrrolidinone, [1-[(4-methoxyphenyl)methyl]-2-oxo-5-pyridin-3-yl-pyrrolidin-3-yl] Acetate
| Molecular Formula | C19H20N2O4 |
|---|---|
| Molecular Weight | 340.14 g/mol |
| LogP | 2.4955 |
| Topological Polar Surface Area | 68.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 340.1423 |
| Heavy Atoms | 25 |
| Complexity | 745.77924 |
Chemical Identifiers
| CAS Number | 887406-83-9 |
|---|---|
| SMILES | CC(=O)OC1CC(N(C1=O)CC2=CC=C(C=C2)OC)C3=CN=CC=C3 |
Product Overview
1-(4-Methoxybenzyl)-3-acetoxynorcotinine (CAS 887406-83-9), with molecular formula C19H20N2O4 and molecular weight 340.14 g/mol. IUPAC: [1-[(4-methoxyphenyl)methyl]-2-oxo-5-pyridin-3-ylpyrrolidin-3-yl] acetate.
Chemical Property Profile of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine
Property Insights of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine
The XLogP value of 2.4955 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methoxybenzyl)-3-acetoxynorcotinine. The TPSA of 68.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methoxybenzyl)-3-acetoxynorcotinine. Following Lipinski's Rule of Five, 1-(4-Methoxybenzyl)-3-acetoxynorcotinine has 0 hydrogen bond donor(s) and 5 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 1-(4-Methoxybenzyl)-3-acetoxynorcotinine?
The CAS number of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine is 887406-83-9.
What is the molecular formula of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine?
The molecular formula of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine is C19H20N2O4.
What is the molecular weight of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine?
The molecular weight of 1-(4-Methoxybenzyl)-3-acetoxynorcotinine is 340.14 g/mol.
Where can I buy 1-(4-Methoxybenzyl)-3-acetoxynorcotinine?
You can request a quote for 1-(4-Methoxybenzyl)-3-acetoxynorcotinine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methoxybenzyl)-3-acetoxynorcotinine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methoxybenzyl)-3-acetoxynorcotinine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.