Methyl ketofexofenadine
TL;DR: Methyl ketofexofenadine (CAS 154477-55-1) is a chemical compound with molecular formula C33H39NO4 and molecular weight 513.2879 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[4-[4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butanoyl]phenyl]-2-methylpropanoate
Also Known As: methyl 2-(4-(4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butanoyl)phenyl)-2-methylpropanoate, Methyl ketofexofenadine, Fexofenadine impurity 23, 1-Oxo Fexofenadine Methyl Ester, 7754AA
Technical Specifications
| Molecular Formula | C33H39NO4 |
| Molecular Weight | 513.2879 g/mol |
| XLogP | 5.7 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 513.2879 Da |
| Heavy Atoms | 38 |
| Complexity | 733.0 |
| SMILES | CC(C)(C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C(=O)OC |
| InChIKey | PGQMZSGBFIPEKX-UHFFFAOYSA-N |
Chemical Property Profile of Methyl ketofexofenadine
Property Insights of Methyl ketofexofenadine
The XLogP value of 5.7 indicates that Methyl ketofexofenadine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl ketofexofenadine. Following Lipinski's Rule of Five, Methyl ketofexofenadine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Methyl ketofexofenadine?
The CAS number of Methyl ketofexofenadine is 154477-55-1.
What is the molecular formula of Methyl ketofexofenadine?
The molecular formula of Methyl ketofexofenadine is C33H39NO4.
What is the molecular weight of Methyl ketofexofenadine?
The molecular weight of Methyl ketofexofenadine is 513.2879 g/mol.
Where can I buy Methyl ketofexofenadine?
You can request a quote for Methyl ketofexofenadine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl ketofexofenadine?
Yes, CoreyChem provides custom synthesis services for Methyl ketofexofenadine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.