TL;DR: Fingolimod phosphate (CAS 1348803-59-7) is a chemical compound with molecular formula C19H34NO5P and molecular weight 387.21747 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-amino-2-(hydroxymethyl)-4-(4-octylphenyl)butyl] dihydrogen phosphate
Also Known As: Fingolimod phosphate, FTY720 phosphate, fingolimod-P, rac FTY720 Phosphate, FTY720-phosphate
| Molecular Formula | C19H34NO5P |
| Molecular Weight | 387.21747 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 387.21747 Da |
| Heavy Atoms | 26 |
| Complexity | 409.0 |
| SMILES | CCCCCCCCC1=CC=C(C=C1)CCC(CO)(COP(=O)(O)O)N |
| InChIKey | LRFKWQGGENFBFO-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fingolimod phosphate. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Fingolimod phosphate. Following Lipinski's Rule of Five, Fingolimod phosphate has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Fingolimod phosphate is 1348803-59-7.
The molecular formula of Fingolimod phosphate is C19H34NO5P.
The molecular weight of Fingolimod phosphate is 387.21747 g/mol.
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