![Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate structure](/static/products/4333/433324-52-8.webp)
Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate
TL;DR: Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate (CAS 433324-52-8) is a chemical compound with molecular formula C19H22N2O2S2 and molecular weight 374.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(4-methylphenyl)sulfanylethylcarbamothioylamino]benzoate
Also Known As: ethyl 4-(3-(2-(p-tolylthio)ethyl)thioureido)benzoate, ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate, ethyl 4-[2-(4-methylphenyl)sulfanylethylcarbamothioylamino]benzoate, ethyl 4-[({[2-(4-methylphenylthio)ethyl]amino}thioxomethyl)amino]benzoate, ETHYL 4-{[({2-[(4-METHYLPHENYL)SULFANYL]ETHYL}AMINO)CARBOTHIOYL]AMINO}BENZOATE
| Molecular Formula | C19H22N2O2S2 |
|---|---|
| Molecular Weight | 374.11 g/mol |
| LogP | 4.25042 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 374.11227 |
| Heavy Atoms | 25 |
| Complexity | 700.36896 |
Chemical Identifiers
| CAS Number | 433324-52-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=S)NCCSC2=CC=C(C=C2)C |
Product Overview
Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate (CAS 433324-52-8), with molecular formula C19H22N2O2S2 and molecular weight 374.11 g/mol. IUPAC: ethyl 4-[2-(4-methylphenyl)sulfanylethylcarbamothioylamino]benzoate.
Chemical Property Profile of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate
Property Insights of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate
The XLogP value of 4.25042 indicates that Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate has 2 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 Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate?
The CAS number of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate is 433324-52-8.
What is the molecular formula of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate?
The molecular formula of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate is C19H22N2O2S2.
What is the molecular weight of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate?
The molecular weight of Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate is 374.11 g/mol.
Where can I buy Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate?
You can request a quote for Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[({2-[(4-methylphenyl)sulfanyl]ethyl}carbamothioyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.