ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE
TL;DR: ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE (CAS 774587-51-8) is a chemical compound with molecular formula C18H18N2O7S and molecular weight 406.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-acetyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate
Also Known As: ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE, ethyl 5-acetyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate, ethyl 5-acetyl-2-[(4-methoxy-3-nitrophenyl)carbonylamino]-4-methylthiophene-3- carboxylate, ethyl 5-acetyl-2-{[(4-methoxy-3-nitrophenyl)carbonyl]amino}-4-methylthiophene-3-carboxylate
| Molecular Formula | C18H18N2O7S |
|---|---|
| Molecular Weight | 406.08 g/mol |
| LogP | 3.60492 |
| Topological Polar Surface Area | 124.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.08347 |
| Heavy Atoms | 28 |
| Complexity | 965.084 |
Chemical Identifiers
| CAS Number | 774587-51-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-] |
Product Overview
ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE (CAS 774587-51-8), with molecular formula C18H18N2O7S and molecular weight 406.08 g/mol. IUPAC: ethyl 5-acetyl-2-[(4-methoxy-3-nitrobenzoyl)amino]-4-methylthiophene-3-carboxylate.
Chemical Property Profile of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE
Property Insights of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE
The XLogP value of 3.60492 indicates that ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.84 Ų falls within the moderate polarity range, balancing permeability and solubility for ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE. Following Lipinski's Rule of Five, ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE has 1 hydrogen bond donor(s) and 8 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 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE?
The CAS number of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE is 774587-51-8.
What is the molecular formula of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE?
The molecular formula of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE is C18H18N2O7S.
What is the molecular weight of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE?
The molecular weight of ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE is 406.08 g/mol.
Where can I buy ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE?
You can request a quote for ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-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 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE?
Yes, KEHONG BIO provides custom synthesis services for ETHYL 5-ACETYL-2-(4-METHOXY-3-NITROBENZAMIDO)-4-METHYLTHIOPHENE-3-CARBOXYLATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.