TL;DR: GW7F8GBV80 (CAS 68318-36-5) is a chemical compound with molecular formula C16H17F17N2O4S and molecular weight 656.0638 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl-[3-(trimethylazaniumyl)propyl]amino]acetate
Also Known As: KST-1B7588, 3-((Carboxymethyl)((heptadecafluorooctyl)sulphonyl)amino)propyltrimethylammonium hydroxide, {[(heptadecafluorooctyl)sulfonyl][3-(trimethylammonio)propyl]amino}acetate, 1-Propanaminium, 3-((carboxymethyl)((heptadecafluorooctyl)sulfonyl)amino)-N,N,N-trimethyl-, inner salt, 1-Propanaminium, 3-((carboxymethyl)((1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)sulfonyl)amino)-N,N,N-trimethyl-, inner salt
| Molecular Formula | C16H17F17N2O4S |
| Molecular Weight | 656.0638 g/mol |
| XLogP | 6.1 |
| Topological Polar Surface Area (TPSA) | 85.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 13 |
| Exact Mass | 656.0638 Da |
| Heavy Atoms | 40 |
| Complexity | 1020.0 |
| SMILES | C[N+](C)(C)CCCN(CC(=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | HBCIQEOSBTUVDJ-UHFFFAOYSA-N |
The XLogP value of 6.1 indicates that GW7F8GBV80 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.9 Ų falls within the moderate polarity range, balancing permeability and solubility for GW7F8GBV80. Following Lipinski's Rule of Five, GW7F8GBV80 has 0 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of GW7F8GBV80 is 68318-36-5.
The molecular formula of GW7F8GBV80 is C16H17F17N2O4S.
The molecular weight of GW7F8GBV80 is 656.0638 g/mol.
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