TL;DR: (2S,5S)-2,6-Diamino-5-fluorohexanoic acid (CAS 130793-71-4) is a chemical compound with molecular formula C6H13FN2O2 and molecular weight 164.0961 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,5S)-2,6-diamino-5-fluorohexanoic acid
Also Known As: L-Lysine,5-fluoro-, -, L-Lysine, 5-fluoro-, (5S)-, 2,6-diamino-5-fluoro-hexanoic Acid, L-Lysine, 5-fluoro-, (5S)- (9CI), (2S,5S)-2,6-Diamino-5-fluorohexanoic acid
| Molecular Formula | C6H13FN2O2 |
| Molecular Weight | 164.0961 g/mol |
| XLogP | -3.2 |
| Topological Polar Surface Area (TPSA) | 89.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 164.0961 Da |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
| SMILES | C(C[C@@H](C(=O)O)N)[C@@H](CN)F |
| InChIKey | HILHCIBEZCWKBD-WHFBIAKZSA-N |
The XLogP value of -3.2 indicates that (2S,5S)-2,6-Diamino-5-fluorohexanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.3 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,5S)-2,6-Diamino-5-fluorohexanoic acid. Following Lipinski's Rule of Five, (2S,5S)-2,6-Diamino-5-fluorohexanoic acid has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (2S,5S)-2,6-Diamino-5-fluorohexanoic acid is 130793-71-4.
The molecular formula of (2S,5S)-2,6-Diamino-5-fluorohexanoic acid is C6H13FN2O2.
The molecular weight of (2S,5S)-2,6-Diamino-5-fluorohexanoic acid is 164.0961 g/mol.
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