TL;DR: Fexofenadine Hydrochloride (CAS 153439-40-8) is a chemical compound with molecular formula C32H40ClNO4 and molecular weight 537.2646 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[1-hydroxy-4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butyl]phenyl]-2-methylpropanoic acid;hydrochloride
Also Known As: FEXOFENADINE HYDROCHLORIDE, FEXOFENADINE HCL, Allegra, Telfast, fexofenadine
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C32H40ClNO4 |
| Molecular Weight | 537.2646 g/mol |
| XLogP | 5.93 |
| Topological Polar Surface Area (TPSA) | 81.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 537.2646 Da |
| Heavy Atoms | 38 |
| Complexity | 678.0 |
| Solubility | 71.8 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | CC(C)(C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O)C(=O)O.Cl |
| InChIKey | RRJFVPUCXDGFJB-UHFFFAOYSA-N |
The XLogP value of 5.93 indicates that Fexofenadine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Fexofenadine Hydrochloride. Following Lipinski's Rule of Five, Fexofenadine Hydrochloride has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Fexofenadine Hydrochloride is 153439-40-8.
The molecular formula of Fexofenadine Hydrochloride is C32H40ClNO4.
The molecular weight of Fexofenadine Hydrochloride is 537.2646 g/mol.
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