methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate
TL;DR: methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate (CAS 588713-02-4) is a chemical compound with molecular formula C20H25N3O4S2 and molecular weight 435.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-ethyl-2-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioylamino]-5-methylthiophene-3-carboxylate
Also Known As: methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate, methyl 4-ethyl-2-[({[2-(4-ethylphenoxy)acetylamino]amino}thioxomethyl)amino]-5 -methylthiophene-3-carboxylate, methyl 4-ethyl-2-[({2-[(4-ethylphenoxy)acetyl]hydrazinyl}carbonothioyl)amino]-5-methylthiophene-3-carboxylate, methyl 4-ethyl-2-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioylamino]-5-methylthiophene-3-carboxylate
| Molecular Formula | C20H25N3O4S2 |
|---|---|
| Molecular Weight | 435.13 g/mol |
| LogP | 3.36452 |
| Topological Polar Surface Area | 88.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 435.12866 |
| Heavy Atoms | 29 |
| Complexity | 878.5966 |
Chemical Identifiers
| CAS Number | 588713-02-4 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)OCC(=O)NNC(=S)NC2=C(C(=C(S2)C)CC)C(=O)OC |
Product Overview
methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate (CAS 588713-02-4), with molecular formula C20H25N3O4S2 and molecular weight 435.13 g/mol. IUPAC: methyl 4-ethyl-2-[[[2-(4-ethylphenoxy)acetyl]amino]carbamothioylamino]-5-methylthiophene-3-carboxylate.
Chemical Property Profile of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate
Property Insights of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate
The XLogP value of 3.36452 indicates that methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.69 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate has 3 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 methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate?
The CAS number of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate is 588713-02-4.
What is the molecular formula of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate?
The molecular formula of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate is C20H25N3O4S2.
What is the molecular weight of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate?
The molecular weight of methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate is 435.13 g/mol.
Where can I buy methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate?
You can request a quote for methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-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 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-ethyl-2-(2-(2-(4-ethylphenoxy)acetyl)hydrazinecarbothioamido)-5-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.