Tropine phenylglycinate dihydrochloride
TL;DR: Tropine phenylglycinate dihydrochloride (CAS 64790-49-4) is a chemical compound with molecular formula C16H24Cl2N2O2 and molecular weight 346.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-amino-2-phenylacetate;dihydrochloride
Also Known As: Tropine phenylglycinate HCl, Tropine phenylglycinate dihydrochloride hydrate, Tropine phenylglycinate dihydrochloride, Glycine, 2-phenyl-, 1-alpha-H,5-alpha-H-tropan-3-alpha-yl ester, dihydrochloride, hydrate, (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-amino-2-phenylacetate dihydrochloride
| Molecular Formula | C16H24Cl2N2O2 |
|---|---|
| Molecular Weight | 346.12 g/mol |
| LogP | 2.6984 |
| Topological Polar Surface Area | 55.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.1215 |
| Heavy Atoms | 22 |
| Complexity | 472.29398 |
Chemical Identifiers
| CAS Number | 64790-49-4 |
|---|---|
| SMILES | CN1C2CCC1CC(C2)OC(=O)C(C3=CC=CC=C3)N.Cl.Cl |
Product Overview
Tropine phenylglycinate dihydrochloride (CAS 64790-49-4), with molecular formula C16H24Cl2N2O2 and molecular weight 346.12 g/mol. IUPAC: (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) 2-amino-2-phenylacetate;dihydrochloride.
Chemical Property Profile of Tropine phenylglycinate dihydrochloride
Property Insights of Tropine phenylglycinate dihydrochloride
The XLogP value of 2.6984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tropine phenylglycinate dihydrochloride. With a topological polar surface area (TPSA) of 55.56 Ų, Tropine phenylglycinate dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tropine phenylglycinate dihydrochloride has 1 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 Tropine phenylglycinate dihydrochloride?
The CAS number of Tropine phenylglycinate dihydrochloride is 64790-49-4.
What is the molecular formula of Tropine phenylglycinate dihydrochloride?
The molecular formula of Tropine phenylglycinate dihydrochloride is C16H24Cl2N2O2.
What is the molecular weight of Tropine phenylglycinate dihydrochloride?
The molecular weight of Tropine phenylglycinate dihydrochloride is 346.12 g/mol.
Where can I buy Tropine phenylglycinate dihydrochloride?
You can request a quote for Tropine phenylglycinate dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tropine phenylglycinate dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Tropine phenylglycinate dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.