S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine
TL;DR: S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine (CAS 35190-57-9) is a chemical compound with molecular formula C10H20I2N2O2S2 and molecular weight 517.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine
Also Known As: Disulfiram-iodine complex, KST-1B3453, Disulfide, bis(diethylthiocarbamoyl)-, compd. with iodine, 1,1',1'',1'''-[disulfanediylbis(carbonylnitrilo)]tetraethane- iodine(1:1), 1-(diethylcarbamoyldisulfanyl)-N,N-diethyl-formamide; molecular iodine
| Molecular Formula | C10H20I2N2O2S2 |
|---|---|
| Molecular Weight | 517.91 g/mol |
| LogP | 5.0628 |
| Topological Polar Surface Area | 91.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 517.9056 |
| Heavy Atoms | 18 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 35190-57-9 |
|---|---|
| SMILES | CCN(CC)C(=O)SSC(=O)N(CC)CC.II |
| InChIKey | PHZVHZSUIRIKFL-UHFFFAOYSA-N |
Product Overview
S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine (CAS 35190-57-9), with molecular formula C10H20I2N2O2S2 and molecular weight 517.91 g/mol. IUPAC: S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine.
Chemical Property Profile of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine
Property Insights of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine
The XLogP value of 5.0628 indicates that S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.2 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine. Following Lipinski's Rule of Five, S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine?
The CAS number of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine is 35190-57-9.
What is the molecular formula of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine?
The molecular formula of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine is C10H20I2N2O2S2.
What is the molecular weight of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine?
The molecular weight of S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine is 517.91 g/mol.
Where can I buy S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine?
You can request a quote for S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine?
Yes, KEHONG BIO provides custom synthesis services for S-(diethylcarbamoylsulfanyl) N,N-diethylcarbamothioate;molecular iodine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.