Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester
TL;DR: Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester (CAS 2801-22-1) is a chemical compound with molecular formula C5H12N2S2 and molecular weight 164.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethylamino N,N-dimethylcarbamodithioate
Also Known As: dimethylamino N,N-dimethylcarbamodithioate, Dimethylaminodimethyldithiocarbaminsaure, Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester, S-(N,N-dimethylthiocarbamoyl)-N,N-dimethylthiohydroxylamine, Methanamine, N-[[(dimethylamino)thioxomethyl]thio]-N-methyl-
| Molecular Formula | C5H12N2S2 |
|---|---|
| Molecular Weight | 164.04 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 63.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.04419 |
| Heavy Atoms | 9 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 2801-22-1 |
|---|---|
| SMILES | CN(C)C(=S)SN(C)C |
| InChIKey | JONUBSSIKZGGRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester (CAS 2801-22-1), with molecular formula C5H12N2S2 and molecular weight 164.04 g/mol. IUPAC: dimethylamino N,N-dimethylcarbamodithioate.
Chemical Property Profile of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester
Property Insights of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester. The TPSA of 63.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester. Following Lipinski's Rule of Five, Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester has 0 hydrogen bond donor(s) and 3 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 Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester?
The CAS number of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester is 2801-22-1.
What is the molecular formula of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester?
The molecular formula of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester is C5H12N2S2.
What is the molecular weight of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester?
The molecular weight of Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester is 164.04 g/mol.
Where can I buy Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester?
You can request a quote for Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester?
Yes, KEHONG BIO provides custom synthesis services for Dithiocarbamic acid, N,N-dimethyl-, S-dimethylamino ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.