TL;DR: Cyclosporin A Sulfate (CAS 121673-00-5) is a chemical compound with molecular formula C62H111N11O15S and molecular weight 1281.7982 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-[5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methylhex-4-enyl] hydrogen sulfate
Also Known As: Cyclosporin A Sulfate, Cyclosporin A sulphate, Cyclosporin A Hydrogen Sulfate (ester); Cyclosporine Sulfate;, [1-[5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecazacyclotritriacont-2-yl]-2-methylhex-4-enyl] hydrogen sulfate, 1-[5-ethyl-1,7,10,16,20,23,25,28,31-nonamethyl-11,17,26,29-tetrakis(2-methylpropyl)-3,6,9,12,15,18,21,24,27,30,33-undecaoxo-14,32-di(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2-yl]-2-methylhex-4-en-1-yl hydrogen sulfate
| Molecular Formula | C62H111N11O15S |
| Molecular Weight | 1281.7982 g/mol |
| XLogP | 6.6 |
| Topological Polar Surface Area (TPSA) | 331.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 17 |
| Exact Mass | 1281.7982 Da |
| Heavy Atoms | 89 |
| Complexity | 2590.0 |
| SMILES | CCC1C(=O)N(CC(=O)N(C(C(=O)NC(C(=O)N(C(C(=O)NC(C(=O)NC(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N(C(C(=O)N1)C(C(C)CC=CC)OS(=O)(=O)O)C)C(C)C)C)CC(C)C)C)CC(C)C)C)C)C)CC(C)C)C)C(C)C)CC(C)C)C)C |
| InChIKey | CQDXGGWUGMQJHS-UHFFFAOYSA-N |
The XLogP value of 6.6 indicates that Cyclosporin A Sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 331.0 Ų indicates high polarity, suggesting Cyclosporin A Sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclosporin A Sulfate has 5 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Cyclosporin A Sulfate is 121673-00-5.
The molecular formula of Cyclosporin A Sulfate is C62H111N11O15S.
The molecular weight of Cyclosporin A Sulfate is 1281.7982 g/mol.
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