N1,N2-Diethylethanedithioamide
TL;DR: N1,N2-Diethylethanedithioamide (CAS 16475-50-6) is a chemical compound with molecular formula C6H12N2S2 and molecular weight 176.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-diethylethanedithioamide
Also Known As: N,N'-Diethyldithiooxamide, N,N'-diethylethanedithioamide, diethyl dithioxamide, Ethanedithioamide, N,N'-diethyl-, Oxamide,N'-diethyldithio-
| Molecular Formula | C6H12N2S2 |
|---|---|
| Molecular Weight | 176.04 g/mol |
| LogP | 0.8602 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.04419 |
| Heavy Atoms | 10 |
| Complexity | 117.7095 |
Chemical Identifiers
| CAS Number | 16475-50-6 |
|---|---|
| SMILES | CCNC(=S)C(=S)NCC |
Product Overview
N1,N2-Diethylethanedithioamide (CAS 16475-50-6), with molecular formula C6H12N2S2 and molecular weight 176.04 g/mol. IUPAC: N,N'-diethylethanedithioamide.
Chemical Property Profile of N1,N2-Diethylethanedithioamide
Property Insights of N1,N2-Diethylethanedithioamide
The XLogP value of 0.8602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1,N2-Diethylethanedithioamide. With a topological polar surface area (TPSA) of 24.06 Ų, N1,N2-Diethylethanedithioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1,N2-Diethylethanedithioamide has 2 hydrogen bond donor(s) and 2 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 N1,N2-Diethylethanedithioamide?
The CAS number of N1,N2-Diethylethanedithioamide is 16475-50-6.
What is the molecular formula of N1,N2-Diethylethanedithioamide?
The molecular formula of N1,N2-Diethylethanedithioamide is C6H12N2S2.
What is the molecular weight of N1,N2-Diethylethanedithioamide?
The molecular weight of N1,N2-Diethylethanedithioamide is 176.04 g/mol.
Where can I buy N1,N2-Diethylethanedithioamide?
You can request a quote for N1,N2-Diethylethanedithioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1,N2-Diethylethanedithioamide?
Yes, KEHONG BIO provides custom synthesis services for N1,N2-Diethylethanedithioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.