TL;DR: Magnesium ionophore III (CAS 119110-38-2) is a chemical compound with molecular formula C30H58N4O4 and molecular weight 538.4458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-heptyl-N-[8-[[3-[heptyl(methyl)amino]-3-oxopropanoyl]amino]octyl]-N'-methylpropanediamide
Also Known As: Magnesium ionophore III, ETH 4030, ETH 4030(Magnesium ionophore III)?, J1.173.613K, N'-heptyl-N-[8-[[3-[heptyl(methyl)amino]-3-oxopropanoyl]amino]octyl]-N'-methylpropanediamide
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C30H58N4O4 |
| Molecular Weight | 538.4458 g/mol |
| XLogP | 6.4 |
| Topological Polar Surface Area (TPSA) | 98.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 25 |
| Exact Mass | 538.4458 Da |
| Heavy Atoms | 38 |
| Complexity | 588.0 |
| SMILES | CCCCCCCN(C)C(=O)CC(=O)NCCCCCCCCNC(=O)CC(=O)N(C)CCCCCCC |
| InChIKey | MXMJPDBVBJZBCA-UHFFFAOYSA-N |
The XLogP value of 6.4 indicates that Magnesium ionophore III is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Magnesium ionophore III. Following Lipinski's Rule of Five, Magnesium ionophore III has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Magnesium ionophore III is 119110-38-2.
The molecular formula of Magnesium ionophore III is C30H58N4O4.
The molecular weight of Magnesium ionophore III is 538.4458 g/mol.
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