Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate
TL;DR: Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate (CAS 726159-98-4) is a chemical compound with molecular formula C22H21NO5S2 and molecular weight 443.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(4-methylphenyl)sulfonylacetyl]amino]-4-phenylthiophene-3-carboxylate
Also Known As: ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate, F1678-0221, ETHYL 2-[2-(4-METHYLBENZENESULFONYL)ACETAMIDO]-4-PHENYLTHIOPHENE-3-CARBOXYLATE, ethyl 2-[[2-(4-methylphenyl)sulfonylacetyl]amino]-4-phenylthiophene-3-carboxylate, ethyl 2-{2-[(4-methylphenyl)sulfonyl]acetylamino}-4-phenylthiophene-3-carboxyl ate
| Molecular Formula | C22H21NO5S2 |
|---|---|
| Molecular Weight | 443.09 g/mol |
| LogP | 4.31262 |
| Topological Polar Surface Area | 89.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 443.08612 |
| Heavy Atoms | 30 |
| Complexity | 1149.9984 |
Chemical Identifiers
| CAS Number | 726159-98-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)CS(=O)(=O)C3=CC=C(C=C3)C |
Product Overview
Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate (CAS 726159-98-4), with molecular formula C22H21NO5S2 and molecular weight 443.09 g/mol. IUPAC: ethyl 2-[[2-(4-methylphenyl)sulfonylacetyl]amino]-4-phenylthiophene-3-carboxylate.
Chemical Property Profile of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate
Property Insights of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate
The XLogP value of 4.31262 indicates that Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-phenyl-2-(2-tosylacetamido)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 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate?
The CAS number of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate is 726159-98-4.
What is the molecular formula of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate?
The molecular formula of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate is C22H21NO5S2.
What is the molecular weight of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate?
The molecular weight of Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate is 443.09 g/mol.
Where can I buy Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate?
You can request a quote for Ethyl 4-phenyl-2-(2-tosylacetamido)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 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-phenyl-2-(2-tosylacetamido)thiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.