6-Ethoxytropine-o-phenoxybenzoate
TL;DR: 6-Ethoxytropine-o-phenoxybenzoate (CAS 767566-47-2) is a chemical compound with molecular formula C23H27NO4 and molecular weight 381.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-ethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenoxybenzoate
Also Known As: 6-Ethoxytropine-o-phenoxybenzoate, Benzoic acid, 2-phenoxy-, 6-ethoxy-8-methyl-8-azabicyclo(3.2.1)oct-3-yl ester, 6-ethoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 2-phenoxybenzoate, (6-ethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenoxybenzoate, (7-ethoxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl) 2-phenoxybenzoate
| Molecular Formula | C23H27NO4 |
|---|---|
| Molecular Weight | 381.19 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.194 |
| Heavy Atoms | 28 |
| Complexity | 521.0 |
Chemical Identifiers
| CAS Number | 767566-47-2 |
|---|---|
| SMILES | CCOC1CC2CC(CC1N2C)OC(=O)C3=CC=CC=C3OC4=CC=CC=C4 |
| InChIKey | FRKQTIPNVDXTLE-UHFFFAOYSA-N |
Product Overview
6-Ethoxytropine-o-phenoxybenzoate (CAS 767566-47-2), with molecular formula C23H27NO4 and molecular weight 381.19 g/mol. IUPAC: (6-ethoxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-phenoxybenzoate.
Chemical Property Profile of 6-Ethoxytropine-o-phenoxybenzoate
Property Insights of 6-Ethoxytropine-o-phenoxybenzoate
The XLogP value of 4.4 indicates that 6-Ethoxytropine-o-phenoxybenzoate 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-Ethoxytropine-o-phenoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Ethoxytropine-o-phenoxybenzoate 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 6-Ethoxytropine-o-phenoxybenzoate?
The CAS number of 6-Ethoxytropine-o-phenoxybenzoate is 767566-47-2.
What is the molecular formula of 6-Ethoxytropine-o-phenoxybenzoate?
The molecular formula of 6-Ethoxytropine-o-phenoxybenzoate is C23H27NO4.
What is the molecular weight of 6-Ethoxytropine-o-phenoxybenzoate?
The molecular weight of 6-Ethoxytropine-o-phenoxybenzoate is 381.19 g/mol.
Where can I buy 6-Ethoxytropine-o-phenoxybenzoate?
You can request a quote for 6-Ethoxytropine-o-phenoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethoxytropine-o-phenoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethoxytropine-o-phenoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.