TL;DR: Quaternium 22 (CAS 51812-80-7) is a chemical compound with molecular formula C13H29ClN2O7 and molecular weight 360.16632 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxyethyl-dimethyl-[3-[[(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoyl]amino]propyl]azanium chloride
Also Known As: QUATERNIUM 22, CERAPHYL 60, Cardioactive hexapeptide, Ceraphyl 60 (Technical Grade), QUATERNIUM 22 [VANDF]
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H29ClN2O7 |
| Molecular Weight | 360.16632 g/mol |
| XLogP | -7.0 |
| Topological Polar Surface Area (TPSA) | 150.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 360.16632 Da |
| Heavy Atoms | 23 |
| Complexity | 328.0 |
| SMILES | C[N+](C)(CCCNC(=O)[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O)CCO.[Cl-] |
| InChIKey | FVEWVVDBRQZLSJ-QTWKXRMISA-N |
The XLogP value of -7.0 indicates that Quaternium 22 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 150.0 Ų indicates high polarity, suggesting Quaternium 22 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Quaternium 22 has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Quaternium 22 is 51812-80-7.
The molecular formula of Quaternium 22 is C13H29ClN2O7.
The molecular weight of Quaternium 22 is 360.16632 g/mol.
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