Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate
TL;DR: Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate (CAS 891276-33-8) is a chemical compound with molecular formula C15H16N2O3S2 and molecular weight 336.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-methyl-2-[(2-pyridin-2-ylsulfanylacetyl)amino]thiophene-3-carboxylate
Also Known As: Ethyl 5-methyl-2-[(2-pyridin-2-ylsulfanylacetyl)amino]thiophene-3-carboxylate, ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate, ethyl 5-methyl-2-(2-(pyridin-2-ylthio)acetamido)thiophene-3-carboxylate, ethyl 5-methyl-2-{[(pyridin-2-ylsulfanyl)acetyl]amino}thiophene-3-carboxylate
| Molecular Formula | C15H16N2O3S2 |
|---|---|
| Molecular Weight | 336.06 g/mol |
| LogP | 3.35902 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.06024 |
| Heavy Atoms | 22 |
| Complexity | 656.0621 |
Chemical Identifiers
| CAS Number | 891276-33-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1)C)NC(=O)CSC2=CC=CC=N2 |
Product Overview
Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate (CAS 891276-33-8), with molecular formula C15H16N2O3S2 and molecular weight 336.06 g/mol. IUPAC: ethyl 5-methyl-2-[(2-pyridin-2-ylsulfanylacetyl)amino]thiophene-3-carboxylate.
Chemical Property Profile of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate
Property Insights of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate
The XLogP value of 3.35902 indicates that Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate has 1 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 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate?
The CAS number of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate is 891276-33-8.
What is the molecular formula of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate?
The molecular formula of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate is C15H16N2O3S2.
What is the molecular weight of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate?
The molecular weight of Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate is 336.06 g/mol.
Where can I buy Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate?
You can request a quote for Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)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 Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-methyl-2-(2-(2-pyridylthio)acetylamino)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.