![methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate structure](/static/products/5886/588679-08-7.webp)
methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
TL;DR: methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate (CAS 588679-08-7) is a chemical compound with molecular formula C17H19N3O3S3 and molecular weight 409.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[(5-ethylthiophene-3-carbonyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-[({[(5-ethyl(3-thienyl))carbonylamino]amino}thioxomethyl)amino]-4,5,6 -trihydrocyclopenta[2,1-b]thiophene-3-carboxylate, methyl 2-[({2-[(5-ethylthiophen-3-yl)carbonyl]hydrazinyl}carbonothioyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, methyl 2-[[(5-ethylthiophene-3-carbonyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C17H19N3O3S3 |
|---|---|
| Molecular Weight | 409.06 g/mol |
| LogP | 3.2787 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 409.05887 |
| Heavy Atoms | 26 |
| Complexity | 856.80054 |
Chemical Identifiers
| CAS Number | 588679-08-7 |
|---|---|
| SMILES | CCC1=CC(=CS1)C(=O)NNC(=S)NC2=C(C3=C(S2)CCC3)C(=O)OC |
Product Overview
methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate (CAS 588679-08-7), with molecular formula C17H19N3O3S3 and molecular weight 409.06 g/mol. IUPAC: methyl 2-[[(5-ethylthiophene-3-carbonyl)amino]carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Property Insights of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
The XLogP value of 3.2787 indicates that methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]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 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate. Following Lipinski's Rule of Five, methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]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 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
The CAS number of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is 588679-08-7.
What is the molecular formula of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
The molecular formula of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is C17H19N3O3S3.
What is the molecular weight of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
The molecular weight of methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate is 409.06 g/mol.
Where can I buy methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
You can request a quote for methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]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 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(2-(5-ethylthiophene-3-carbonyl)hydrazinecarbothioamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.