![methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate structure](/static/products/5886/588680-82-4.webp)
methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
TL;DR: methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate (CAS 588680-82-4) is a chemical compound with molecular formula C19H23N3O3S3 and molecular weight 437.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-ethyl-2-[[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate
Also Known As: methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate, methyl 5-ethyl-2-(2-(6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonyl)hydrazinecarbothioamido)thiophene-3-carboxylate, methyl 5-ethyl-2-[({[(6-methyl(4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl))carbon ylamino]amino}thioxomethyl)amino]thiophene-3-carboxylate, methyl 5-ethyl-2-[[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate
| Molecular Formula | C19H23N3O3S3 |
|---|---|
| Molecular Weight | 437.09 g/mol |
| LogP | 3.9148 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 437.09015 |
| Heavy Atoms | 28 |
| Complexity | 903.6163 |
Chemical Identifiers
| CAS Number | 588680-82-4 |
|---|---|
| SMILES | CCC1=CC(=C(S1)NC(=S)NNC(=O)C2=CSC3=C2CCC(C3)C)C(=O)OC |
Product Overview
methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate (CAS 588680-82-4), with molecular formula C19H23N3O3S3 and molecular weight 437.09 g/mol. IUPAC: methyl 5-ethyl-2-[[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl)amino]carbamothioylamino]thiophene-3-carboxylate.
Chemical Property Profile of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
Property Insights of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate
The XLogP value of 3.9148 indicates that methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-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 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
The CAS number of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is 588680-82-4.
What is the molecular formula of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
The molecular formula of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is C19H23N3O3S3.
What is the molecular weight of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
The molecular weight of methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate is 437.09 g/mol.
Where can I buy methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
You can request a quote for methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)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-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-ethyl-2-[({2-[(6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.