TL;DR: 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate (CAS 1093619-04-5) is a chemical compound with molecular formula C26H40N2O10 and molecular weight 540.2683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2,4,5-triacetyloxy-1,6-bis(cyclohexylamino)-1,6-dioxohexan-3-yl] acetate
Also Known As: [2,3,4-triacetyloxy-1,4-bis(cyclohexylcarbamoyl)butyl] Acetate|[2,4,5-triacetyloxy-1,6-bis(cyclohexylamino)-1,6-dioxohexan-3-yl] acetate|1,6-bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate|1,6-bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate (non-preferred name)|STK578908
| Molecular Formula | C26H40N2O10 |
| Molecular Weight | 540.2683 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 163.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 15 |
| Exact Mass | 540.2683 Da |
| Heavy Atoms | 38 |
| Complexity | 794.0 |
| SMILES | CC(=O)OC(C(C(C(=O)NC1CCCCC1)OC(=O)C)OC(=O)C)C(C(=O)NC2CCCCC2)OC(=O)C |
| InChIKey | NBTJDPSAJZDMSX-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate. The TPSA of 163.0 Ų indicates high polarity, suggesting 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate is 1093619-04-5.
The molecular formula of 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate is C26H40N2O10.
The molecular weight of 1,6-Bis(cyclohexylamino)-1,6-dioxohexane-2,3,4,5-tetrayl tetraacetate is 540.2683 g/mol.
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