Methylenebis(N,N-diethyldithiocarbamate)
TL;DR: Methylenebis(N,N-diethyldithiocarbamate) (CAS 28535-08-2) is a chemical compound with molecular formula C11H22N2S4 and molecular weight 310.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethylcarbamothioylsulfanylmethyl N,N-diethylcarbamodithioate
Also Known As: Methylenebis(N,N-diethyldithiocarbamate), methylene bis-(di-ethylamino-dithioformate), Methanediyl bis(N,N-diethyldithiocarbamate), Bis(N,N-diethyldithiocarbamic acid)methylene ester, diethylcarbamothioylsulfanylmethyl N,N-diethylcarbamodithioate
| Molecular Formula | C11H22N2S4 |
|---|---|
| Molecular Weight | 310.07 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 310.0666 |
| Heavy Atoms | 17 |
| Complexity | 214.0 |
Chemical Identifiers
| CAS Number | 28535-08-2 |
|---|---|
| SMILES | CCN(CC)C(=S)SCSC(=S)N(CC)CC |
| InChIKey | GEKMQLNEANPVFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methylenebis(N,N-diethyldithiocarbamate) (CAS 28535-08-2), with molecular formula C11H22N2S4 and molecular weight 310.07 g/mol. IUPAC: diethylcarbamothioylsulfanylmethyl N,N-diethylcarbamodithioate.
Chemical Property Profile of Methylenebis(N,N-diethyldithiocarbamate)
Property Insights of Methylenebis(N,N-diethyldithiocarbamate)
The XLogP value of 3.9 indicates that Methylenebis(N,N-diethyldithiocarbamate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methylenebis(N,N-diethyldithiocarbamate). Following Lipinski's Rule of Five, Methylenebis(N,N-diethyldithiocarbamate) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methylenebis(N,N-diethyldithiocarbamate)?
The CAS number of Methylenebis(N,N-diethyldithiocarbamate) is 28535-08-2.
What is the molecular formula of Methylenebis(N,N-diethyldithiocarbamate)?
The molecular formula of Methylenebis(N,N-diethyldithiocarbamate) is C11H22N2S4.
What is the molecular weight of Methylenebis(N,N-diethyldithiocarbamate)?
The molecular weight of Methylenebis(N,N-diethyldithiocarbamate) is 310.07 g/mol.
Where can I buy Methylenebis(N,N-diethyldithiocarbamate)?
You can request a quote for Methylenebis(N,N-diethyldithiocarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylenebis(N,N-diethyldithiocarbamate)?
Yes, KEHONG BIO provides custom synthesis services for Methylenebis(N,N-diethyldithiocarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.