3-alpha-Tropanol, 3,3-diphenylpropionate
TL;DR: 3-alpha-Tropanol, 3,3-diphenylpropionate (CAS 23722-85-2) is a chemical compound with molecular formula C23H27NO2 and molecular weight 349.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]-3-phenylpropanoic acid
Also Known As: 3-alpha-Tropanol, 3,3-diphenylpropionate, 3,3-Diphenylpropionic acid 3-alpha-tropanyl ester, 3-[3-(8-methyl-8-azabicyclo[3.2.1]oct-3-yl)phenyl]-3-phenylpropanoic acid, Propionic acid, 3,3-diphenyl-, 3-alpha-tropanyl ester, 3-phenyl-propionic acid tropane-3endo-yl ester
| Molecular Formula | C23H27NO2 |
|---|---|
| Molecular Weight | 349.20 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.2042 |
| Heavy Atoms | 26 |
| Complexity | 473.0 |
Chemical Identifiers
| CAS Number | 23722-85-2 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)C3=CC(=CC=C3)C(CC(=O)O)C4=CC=CC=C4 |
| InChIKey | LKUIWRRZERHFOB-UHFFFAOYSA-N |
Product Overview
3-alpha-Tropanol, 3,3-diphenylpropionate (CAS 23722-85-2), with molecular formula C23H27NO2 and molecular weight 349.20 g/mol. IUPAC: 3-[3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)phenyl]-3-phenylpropanoic acid.
Chemical Property Profile of 3-alpha-Tropanol, 3,3-diphenylpropionate
Property Insights of 3-alpha-Tropanol, 3,3-diphenylpropionate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-alpha-Tropanol, 3,3-diphenylpropionate. With a topological polar surface area (TPSA) of 40.5 Ų, 3-alpha-Tropanol, 3,3-diphenylpropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-alpha-Tropanol, 3,3-diphenylpropionate has 1 hydrogen bond donor(s) and 3 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 3-alpha-Tropanol, 3,3-diphenylpropionate?
The CAS number of 3-alpha-Tropanol, 3,3-diphenylpropionate is 23722-85-2.
What is the molecular formula of 3-alpha-Tropanol, 3,3-diphenylpropionate?
The molecular formula of 3-alpha-Tropanol, 3,3-diphenylpropionate is C23H27NO2.
What is the molecular weight of 3-alpha-Tropanol, 3,3-diphenylpropionate?
The molecular weight of 3-alpha-Tropanol, 3,3-diphenylpropionate is 349.20 g/mol.
Where can I buy 3-alpha-Tropanol, 3,3-diphenylpropionate?
You can request a quote for 3-alpha-Tropanol, 3,3-diphenylpropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-alpha-Tropanol, 3,3-diphenylpropionate?
Yes, KEHONG BIO provides custom synthesis services for 3-alpha-Tropanol, 3,3-diphenylpropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.