Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester
TL;DR: Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester (CAS 20975-53-5) is a chemical compound with molecular formula C11H12ClNO2S2 and molecular weight 289.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (4-chloro-3-methylphenyl)carbamothioylsulfanylformate
Also Known As: Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester, ethyl (4-chloro-3-methylphenyl)carbamothioylsulfanylformate, Thiocarbonic acid anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid ethyl ester, RefChem:333438
| Molecular Formula | C11H12ClNO2S2 |
|---|---|
| Molecular Weight | 289.00 g/mol |
| LogP | 4.23492 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 288.9998 |
| Heavy Atoms | 17 |
| Complexity | 437.47964 |
Chemical Identifiers
| CAS Number | 20975-53-5 |
|---|---|
| SMILES | CCOC(=O)SC(=S)NC1=CC(=C(C=C1)Cl)C |
Product Overview
Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester (CAS 20975-53-5), with molecular formula C11H12ClNO2S2 and molecular weight 289.00 g/mol. IUPAC: ethyl (4-chloro-3-methylphenyl)carbamothioylsulfanylformate.
Chemical Property Profile of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester
Property Insights of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester
The XLogP value of 4.23492 indicates that Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester has 1 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 Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester?
The CAS number of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester is 20975-53-5.
What is the molecular formula of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester?
The molecular formula of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester is C11H12ClNO2S2.
What is the molecular weight of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester?
The molecular weight of Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester is 289.00 g/mol.
Where can I buy Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester?
You can request a quote for Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbonic acid, thio-, anhydrosulfide with 4-chloro-3-methyldithiocarbanilic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.