![ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate structure](/static/products/7082/708243-96-3.webp)
ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate
TL;DR: ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate (CAS 708243-96-3) is a chemical compound with molecular formula C13H18N2O4S2 and molecular weight 330.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(2-ethoxy-2-oxoethyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate
Also Known As: ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate, methyl 2-(3-(2-ethoxy-2-oxoethyl)thioureido)-5-ethylthiophene-3-carboxylate, methyl 2-[(2-ethoxy-2-oxoethyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate, methyl 2-{[(2-ethoxy-2-oxoethyl)carbamothioyl]amino}-5-ethylthiophene-3-carboxylate
| Molecular Formula | C13H18N2O4S2 |
|---|---|
| Molecular Weight | 330.07 g/mol |
| LogP | 1.9466 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 330.0708 |
| Heavy Atoms | 21 |
| Complexity | 528.24097 |
Chemical Identifiers
| CAS Number | 708243-96-3 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=S)NCC(=O)OCC)C(=O)OC |
Product Overview
ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate (CAS 708243-96-3), with molecular formula C13H18N2O4S2 and molecular weight 330.07 g/mol. IUPAC: methyl 2-[(2-ethoxy-2-oxoethyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate.
Chemical Property Profile of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate
Property Insights of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate
The XLogP value of 1.9466 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate. Following Lipinski's Rule of Five, ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate has 2 hydrogen bond donor(s) and 6 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 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate?
The CAS number of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate is 708243-96-3.
What is the molecular formula of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate?
The molecular formula of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate is C13H18N2O4S2.
What is the molecular weight of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate?
The molecular weight of ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate is 330.07 g/mol.
Where can I buy ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate?
You can request a quote for ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-[({[5-ethyl-3-(methoxycarbonyl)(2-thienyl)]amino}thioxomethyl)amino]ac etate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.