TL;DR: Dicurin procaine (CAS 63907-34-6) is a chemical compound with molecular formula C28H42HgN3O9 and molecular weight 766.26276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-aminobenzoyl)oxyethyl-diethylazanium;[3-[[2-(carboxylatomethoxy)benzoyl]amino]-2-(2-methoxyethoxy)propyl]mercury;hydrate
Also Known As: Dicurin procaine, Merethoxylline procaine, Acetic acid, (o-((3-(hydroxymercuri)-2-(2-methoxyethoxy)propyl)carbamoyl)phenoxy)-, compd. with procaine, Mercurate(1-), hydroxy[[2-[[[2-(2-methoxyethoxy)propyl]amino]carbonyl]phenoxy]acetato(2-)]-, hydrogen, compd. with ethyl 4-amino-2-(diethylamino)benzoate (1:1)
| Molecular Formula | C28H42HgN3O9 |
| Molecular Weight | 766.26276 g/mol |
| XLogP | -0.93 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 18 |
| Exact Mass | 766.26276 Da |
| Heavy Atoms | 41 |
| Complexity | 586.0 |
| SMILES | CC[NH+](CC)CCOC(=O)C1=CC=C(C=C1)N.COCCOC(CNC(=O)C1=CC=CC=C1OCC(=O)[O-])C[Hg].O |
| InChIKey | HESFRMMKCMMNMR-UHFFFAOYSA-N |
The XLogP value of -0.93 indicates that Dicurin procaine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 155.0 Ų indicates high polarity, suggesting Dicurin procaine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dicurin procaine has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Dicurin procaine is 63907-34-6.
The molecular formula of Dicurin procaine is C28H42HgN3O9.
The molecular weight of Dicurin procaine is 766.26276 g/mol.
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