![methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate structure](/static/products/7082/708248-24-2.webp)
methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate
TL;DR: methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate (CAS 708248-24-2) is a chemical compound with molecular formula C24H26N2O4S2 and molecular weight 470.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-benzyl-2-[1-(2,5-dimethoxyphenyl)ethylcarbamothioylamino]thiophene-3-carboxylate
Also Known As: methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate, methyl 5-benzyl-2-(3-(1-(2,5-dimethoxyphenyl)ethyl)thioureido)thiophene-3-carboxylate, methyl 5-benzyl-2-[1-(2,5-dimethoxyphenyl)ethylcarbamothioylamino]thiophene-3-carboxylate, methyl 2-[({[(2,5-dimethoxyphenyl)ethyl]amino}thioxomethyl)amino]-5-benzylthio phene-3-carboxylate
| Molecular Formula | C24H26N2O4S2 |
|---|---|
| Molecular Weight | 470.13 g/mol |
| LogP | 5.1903 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 470.1334 |
| Heavy Atoms | 32 |
| Complexity | 1082.8582 |
Chemical Identifiers
| CAS Number | 708248-24-2 |
|---|---|
| SMILES | CC(C1=C(C=CC(=C1)OC)OC)NC(=S)NC2=C(C=C(S2)CC3=CC=CC=C3)C(=O)OC |
Product Overview
methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate (CAS 708248-24-2), with molecular formula C24H26N2O4S2 and molecular weight 470.13 g/mol. IUPAC: methyl 5-benzyl-2-[1-(2,5-dimethoxyphenyl)ethylcarbamothioylamino]thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate
Property Insights of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate
The XLogP value of 5.1903 indicates that methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate?
The CAS number of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate is 708248-24-2.
What is the molecular formula of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate?
The molecular formula of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate is C24H26N2O4S2.
What is the molecular weight of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate?
The molecular weight of methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate is 470.13 g/mol.
Where can I buy methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate?
You can request a quote for methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-benzyl-2-({[1-(2,5-dimethoxyphenyl)ethyl]carbamothioyl}amino)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.