![Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate structure](/static/products/896/896323-45-8.png)
Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate
TL;DR: Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate (CAS 896323-45-8) is a chemical compound with molecular formula C21H18N2O3S and molecular weight 378.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-cyano-3-methyl-5-[(2-naphthalen-1-ylacetyl)amino]thiophene-2-carboxylate
Also Known As: ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate, F2590-0791, ethyl 4-cyano-3-methyl-5-(2-(naphthalen-1-yl)acetamido)thiophene-2-carboxylate, ethyl 4-cyano-3-methyl-5-[(2-naphthalen-1-ylacetyl)amino]thiophene-2-carboxylate
| Molecular Formula | C21H18N2O3S |
|---|---|
| Molecular Weight | 378.10 g/mol |
| LogP | 4.4393 |
| Topological Polar Surface Area | 79.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.10382 |
| Heavy Atoms | 27 |
| Complexity | 1057.7142 |
Chemical Identifiers
| CAS Number | 896323-45-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(S1)NC(=O)CC2=CC=CC3=CC=CC=C32)C#N)C |
Product Overview
Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate (CAS 896323-45-8), with molecular formula C21H18N2O3S and molecular weight 378.10 g/mol. IUPAC: ethyl 4-cyano-3-methyl-5-[(2-naphthalen-1-ylacetyl)amino]thiophene-2-carboxylate.
Chemical Property Profile of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate
Property Insights of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate
The XLogP value of 4.4393 indicates that Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate has 1 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 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate?
The CAS number of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate is 896323-45-8.
What is the molecular formula of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate?
The molecular formula of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate is C21H18N2O3S.
What is the molecular weight of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate?
The molecular weight of Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate is 378.10 g/mol.
Where can I buy Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate?
You can request a quote for Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-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-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-cyano-3-methyl-5-[2-(naphthalen-1-yl)acetamido]thiophene-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.