6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐
TL;DR: 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 (CAS 22242-40-6) is a chemical compound with molecular formula C23H28BrNO4 and molecular weight 461.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐
(6-ethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenoxybenzoate;hydrobromide
Also Known As: 6-Ethoxytropine-o-phenoxybenzoate hydrobromide, 6-Ethoxytropine, hydrobromide, o-phenoxybenzoic acid ester, 6-ETHOXYTROPINE-O-PHENOXY-BENZOIC ACID ESTER HYDROBROMIDE, Benzoic acid, 2-phenoxy-, 6-ethoxy-8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, hydrobromide (1:1), (6-ethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenoxybenzoate hydrobromide
| Molecular Formula | C23H28BrNO4 |
|---|---|
| Molecular Weight | 461.12 g/mol |
| LogP | 4.85 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 461.12018 |
| Heavy Atoms | 29 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 22242-40-6 |
|---|---|
| SMILES | CCOC1CC2CC(CC1N2C)OC(=O)C3=CC=CC=C3OC4=CC=CC=C4.Br |
| InChIKey | NMILJCWGUUWSED-UHFFFAOYSA-N |
Product Overview
6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 (CAS 22242-40-6), with molecular formula C23H28BrNO4 and molecular weight 461.12 g/mol. IUPAC: (6-ethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenoxybenzoate;hydrobromide.
Chemical Property Profile of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐
Property Insights of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐
The XLogP value of 4.85 indicates that 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.0 Ų, 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 has 1 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 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐?
The CAS number of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 is 22242-40-6.
What is the molecular formula of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐?
The molecular formula of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 is C23H28BrNO4.
What is the molecular weight of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐?
The molecular weight of 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 is 461.12 g/mol.
Where can I buy 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐?
You can request a quote for 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐?
Yes, KEHONG BIO provides custom synthesis services for 6-乙氧基托品邻苯氧基苯甲酸酯氢溴酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.