Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate
TL;DR: Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate (CAS 847047-75-0) is a chemical compound with molecular formula C26H21NO7S and molecular weight 491.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-ethyl 2-O-methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate
Also Known As: Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate, 4-ethyl 2-methyl 3-methyl-5-({[4-(2-oxo-2H-chromen-3-yl)phenyl]carbonyl}amino)thiophene-2,4-dicarboxylate, 4-ethyl 2-methyl 3-methyl-5-(4-(2-oxo-2H-chromen-3-yl)benzamido)thiophene-2,4-dicarboxylate, 4-ethyl 2-methyl 3-methyl-5-{[4-(2-oxo-2H-chromen-3-yl)benzoyl]amino}thiophene-2,4-dicarboxylate, 4-O-ethyl 2-O-methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate
| Molecular Formula | C26H21NO7S |
|---|---|
| Molecular Weight | 491.10 g/mol |
| LogP | 5.04552 |
| Topological Polar Surface Area | 111.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 491.10388 |
| Heavy Atoms | 35 |
| Complexity | 1498.6615 |
Chemical Identifiers
| CAS Number | 847047-75-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C2=CC=C(C=C2)C3=CC4=CC=CC=C4OC3=O |
Product Overview
Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate (CAS 847047-75-0), with molecular formula C26H21NO7S and molecular weight 491.10 g/mol. IUPAC: 4-O-ethyl 2-O-methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate.
Chemical Property Profile of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate
Property Insights of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate
The XLogP value of 5.04552 indicates that Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate?
The CAS number of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate is 847047-75-0.
What is the molecular formula of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate?
The molecular formula of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate is C26H21NO7S.
What is the molecular weight of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate?
The molecular weight of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate is 491.10 g/mol.
Where can I buy Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate?
You can request a quote for Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.