TL;DR: Mivacurium (CAS 106791-40-6) is a chemical compound with molecular formula C58H80N2O14+2 and molecular weight 1028.5609 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis[3-[6,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-3,4-dihydro-1H-isoquinolin-2-ium-2-yl]propyl] oct-4-enedioate
Also Known As: Mivacurium, MIVACURIUM CHLORIDE, Mivacurium mixture of isomers, 2,2'-[(1,8-dioxooct-4-ene-1,8-diyl)bis(oxypropane-3,1-diyl)]bis[6,7-dimethoxy-2-methyl-1-(3,4,5-trimethoxybenzyl)-1,2,3,4-tetrahydroisoquinolinium], 2,2'-[(1,8-Dioxooct-4-ene-1,8-diyl)bis(oxypropane-3,1-diyl)]bis{6,7-dimethoxy-2-methyl-1-[(3,4,5-trimethoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinolin-2-ium}
| Molecular Formula | C58H80N2O14+2 |
| Molecular Weight | 1028.5609 g/mol |
| XLogP | 8.7 |
| Topological Polar Surface Area (TPSA) | 145.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 30 |
| Exact Mass | 1028.5609 Da |
| Heavy Atoms | 74 |
| Complexity | 1550.0 |
| SMILES | C[N+]1(CCC2=CC(=C(C=C2C1CC3=CC(=C(C(=C3)OC)OC)OC)OC)OC)CCCOC(=O)CCC=CCCC(=O)OCCC[N+]4(CCC5=CC(=C(C=C5C4CC6=CC(=C(C(=C6)OC)OC)OC)OC)OC)C |
| InChIKey | ILVYCEVXHALBSC-UHFFFAOYSA-N |
The XLogP value of 8.7 indicates that Mivacurium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting Mivacurium may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mivacurium has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Mivacurium is 106791-40-6.
The molecular formula of Mivacurium is C58H80N2O14+2.
The molecular weight of Mivacurium is 1028.5609 g/mol.
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