Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate structure

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

CAS: 847047-75-0
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.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Ethyl Methyl 3-methyl-5-[[4-(2-oxochromen-3-yl)benzoyl]amino]thiophene-2,4-dicarboxylate

XLogP
5.04552
TPSA (Topological Polar Surface Area)
111.91
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
8
Rotatable Bonds
6
Heavy Atoms
35
Complexity
1498.6615
Exact Mass
491.10388
Monoisotopic Mass
491.10388
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

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.

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