TL;DR: Lnf 209 (CAS 144979-06-6) is a chemical compound with molecular formula C27H46ClNO7 and molecular weight 531.29626 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (3S,8R,9S,10S,13R,14S,17S)-14-amino-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-17-carboxylate;hydrochloride
Also Known As: Lnf 209, Methyl (3S,8R,9S,10S,13R,14S,17S)-14-amino-10,13-dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-17-carboxylate;hydrochloride, (3 beta,5 beta,14 beta,17 beta)-14-amino-3-((6-deoxy-alpha-L-mannopyranosyl)oxy)androstane-17-carboxylic acid methyl ester, (3beta,5beta,14beta,17beta)-14-Amino-3-((6-deoxy-alpha-L-mannopyranosyl)oxy)androstane-17-carboxylic acid methyl ester, methyl (3S,8R,9S,10S,13R,14S,17S)-14-amino-10,13-dimethyl-3-(((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)hexadecahydro-1H-cyclopenta[a]phenanthrene-17-carboxylate hydrochloride
| Molecular Formula | C27H46ClNO7 |
| Molecular Weight | 531.29626 g/mol |
| XLogP | 2.5341 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 531.29626 Da |
| Heavy Atoms | 36 |
| Complexity | 825.0 |
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CC[C@@]3([C@H]4CC[C@@]5([C@H](CC[C@@]5([C@@H]4CCC3C2)N)C(=O)OC)C)C)O)O)O.Cl |
| InChIKey | XIKOUXLAXLNRBF-TZSNKFELSA-N |
The XLogP value of 2.5341 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lnf 209. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Lnf 209. Following Lipinski's Rule of Five, Lnf 209 has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Lnf 209 is 144979-06-6.
The molecular formula of Lnf 209 is C27H46ClNO7.
The molecular weight of Lnf 209 is 531.29626 g/mol.
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