Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate
TL;DR: Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate (CAS 599150-52-4) is a chemical compound with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate
Also Known As: BAS 09587842, A3095/0131012, ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate, 2-Acetylamino-5-cyclopentylcarbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl, 2-Acetylamino-5-cyclopentylcarbamoyl-4-methyl-thiophene-3-carboxylic acid ethyl ester
| Molecular Formula | C16H22N2O4S |
|---|---|
| Molecular Weight | 338.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.13004 |
| Heavy Atoms | 23 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 599150-52-4 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)NC2CCCC2)NC(=O)C |
| InChIKey | NCJJXUPPJBYMDQ-UHFFFAOYSA-N |
Product Overview
Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate (CAS 599150-52-4), with molecular formula C16H22N2O4S and molecular weight 338.13 g/mol. IUPAC: ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate.
Chemical Property Profile of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate
Property Insights of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate
The XLogP value of 3.1 indicates that Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate has 2 hydrogen bond donor(s) and 5 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 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate?
The CAS number of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate is 599150-52-4.
What is the molecular formula of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate?
The molecular formula of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate is C16H22N2O4S.
What is the molecular weight of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate?
The molecular weight of Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate is 338.13 g/mol.
Where can I buy Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate?
You can request a quote for Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-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 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-acetamido-5-(cyclopentylcarbamoyl)-4-methylthiophene-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.