rac trans-1,2-Bis(thioacetateacetamido)cyclohexane
TL;DR: rac trans-1,2-Bis(thioacetateacetamido)cyclohexane (CAS 1217640-42-0) is a chemical compound with molecular formula C14H22N2O4S2 and molecular weight 346.1021 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-[2-[[2-[(2-acetylsulfanylacetyl)amino]cyclohexyl]amino]-2-oxoethyl] ethanethioate
Also Known As: rac trans-1,2-Bis(thioacetateacetamido)cyclohexane, 2-acetylsulfanyl-N-[2-[(2-acetylsulfanylacetyl)amino]cyclohexyl]acetamide, S-[2-[[2-[(2-acetylsulfanylacetyl)amino]cyclohexyl]amino]-2-oxoethyl] ethanethioate
Technical Specifications
| Molecular Formula | C14H22N2O4S2 |
| Molecular Weight | 346.1021 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 143.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 346.1021 Da |
| Heavy Atoms | 22 |
| Complexity | 403.0 |
| SMILES | CC(=O)SCC(=O)NC1CCCCC1NC(=O)CSC(=O)C |
| InChIKey | CFZAYVVXCBEZLA-UHFFFAOYSA-N |
Chemical Property Profile of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane
Property Insights of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rac trans-1,2-Bis(thioacetateacetamido)cyclohexane. The TPSA of 143.0 Ų indicates high polarity, suggesting rac trans-1,2-Bis(thioacetateacetamido)cyclohexane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, rac trans-1,2-Bis(thioacetateacetamido)cyclohexane has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane?
The CAS number of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane is 1217640-42-0.
What is the molecular formula of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane?
The molecular formula of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane is C14H22N2O4S2.
What is the molecular weight of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane?
The molecular weight of rac trans-1,2-Bis(thioacetateacetamido)cyclohexane is 346.1021 g/mol.
Where can I buy rac trans-1,2-Bis(thioacetateacetamido)cyclohexane?
You can request a quote for rac trans-1,2-Bis(thioacetateacetamido)cyclohexane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for rac trans-1,2-Bis(thioacetateacetamido)cyclohexane?
Yes, CoreyChem provides custom synthesis services for rac trans-1,2-Bis(thioacetateacetamido)cyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.