Benzylidene bis(dimethyldithiocarbamate)
TL;DR: Benzylidene bis(dimethyldithiocarbamate) (CAS 49773-60-6) is a chemical compound with molecular formula C13H18N2S4 and molecular weight 330.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[dimethylcarbamothioylsulfanyl(phenyl)methyl] N,N-dimethylcarbamodithioate
Also Known As: Benzylidene bis(dimethyldithiocarbamate), EINECS 256-484-0, Phenylmethylene bis(dimethylcarbamodithioate), [dimethylcarbamothioylsulfanyl(phenyl)methyl] N,N-dimethylcarbamodithioate
| Molecular Formula | C13H18N2S4 |
|---|---|
| Molecular Weight | 330.04 g/mol |
| LogP | 3.8446 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.03528 |
| Heavy Atoms | 19 |
| Complexity | 409.52917 |
Chemical Identifiers
| CAS Number | 49773-60-6 |
|---|---|
| SMILES | CN(C)C(=S)SC(C1=CC=CC=C1)SC(=S)N(C)C |
Product Overview
Benzylidene bis(dimethyldithiocarbamate) (CAS 49773-60-6), with molecular formula C13H18N2S4 and molecular weight 330.04 g/mol. IUPAC: [dimethylcarbamothioylsulfanyl(phenyl)methyl] N,N-dimethylcarbamodithioate.
Chemical Property Profile of Benzylidene bis(dimethyldithiocarbamate)
Property Insights of Benzylidene bis(dimethyldithiocarbamate)
The XLogP value of 3.8446 indicates that Benzylidene bis(dimethyldithiocarbamate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, Benzylidene bis(dimethyldithiocarbamate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylidene bis(dimethyldithiocarbamate) 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 Benzylidene bis(dimethyldithiocarbamate)?
The CAS number of Benzylidene bis(dimethyldithiocarbamate) is 49773-60-6.
What is the molecular formula of Benzylidene bis(dimethyldithiocarbamate)?
The molecular formula of Benzylidene bis(dimethyldithiocarbamate) is C13H18N2S4.
What is the molecular weight of Benzylidene bis(dimethyldithiocarbamate)?
The molecular weight of Benzylidene bis(dimethyldithiocarbamate) is 330.04 g/mol.
Where can I buy Benzylidene bis(dimethyldithiocarbamate)?
You can request a quote for Benzylidene bis(dimethyldithiocarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylidene bis(dimethyldithiocarbamate)?
Yes, KEHONG BIO provides custom synthesis services for Benzylidene bis(dimethyldithiocarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.