N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane
TL;DR: N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane (CAS 51122-73-7) is a chemical compound with molecular formula C14H28N2O2S2 and molecular weight 320.1592 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-(2-methylpropyl) N-ethyl-N-[2-(2-methylpropylsulfanylcarbonylamino)ethyl]carbamothioate
Also Known As: N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane, -Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane, Carbamothioic acid, ethyl(2-((((2-methylpropyl)thio)carbonyl)amino)ethyl)-, S-(2-methylpropyl) ester, S-(2-methylpropyl) N-ethyl-N-[2-(2-methylpropylsulfanylcarbonylamino)ethyl]carbamothioate, N-[2-(ethyl-(2-methylpropylsulfanylcarbonyl)amino)ethyl]-1-(2-methylpropylsulfanyl)formamide
Technical Specifications
| Molecular Formula | C14H28N2O2S2 |
| Molecular Weight | 320.1592 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 320.1592 Da |
| Heavy Atoms | 20 |
| Complexity | 297.0 |
| SMILES | CCN(CCNC(=O)SCC(C)C)C(=O)SCC(C)C |
| InChIKey | PCNVGFGGUCULPT-UHFFFAOYSA-N |
Chemical Property Profile of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane
Property Insights of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane
The XLogP value of 4.0 indicates that N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane. Following Lipinski's Rule of Five, N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane?
The CAS number of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane is 51122-73-7.
What is the molecular formula of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane?
The molecular formula of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane is C14H28N2O2S2.
What is the molecular weight of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane?
The molecular weight of N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane is 320.1592 g/mol.
Where can I buy N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane?
You can request a quote for N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane?
Yes, CoreyChem provides custom synthesis services for N-Ethyl-1,2-bis(isobutylthiolcarbamoyl)ethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.