TL;DR: Fingolimod Hydrochloride (CAS 162359-56-0) is a chemical compound with molecular formula C19H34ClNO2 and molecular weight 343.2278 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol;hydrochloride
Also Known As: Fingolimod hydrochloride, Fingolimod HCl, Fingolimod, Gilenia, Gilenya
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C19H34ClNO2 |
| Molecular Weight | 343.2278 g/mol |
| XLogP | 3.63 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 343.2278 Da |
| Heavy Atoms | 23 |
| Complexity | 258.0 |
| SMILES | CCCCCCCCC1=CC=C(C=C1)CCC(CO)(CO)N.Cl |
| InChIKey | SWZTYAVBMYWFGS-UHFFFAOYSA-N |
The XLogP value of 3.63 indicates that Fingolimod Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Fingolimod Hydrochloride. Following Lipinski's Rule of Five, Fingolimod Hydrochloride has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Fingolimod Hydrochloride is 162359-56-0.
The molecular formula of Fingolimod Hydrochloride is C19H34ClNO2.
The molecular weight of Fingolimod Hydrochloride is 343.2278 g/mol.
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