2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate
TL;DR: 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate (CAS 1007927-94-7) is a chemical compound with molecular formula C19H18N2O7S and molecular weight 418.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-O-ethyl 4-O-methyl 5-[3-(N-hydroxyanilino)-2,5-dioxopyrrolidin-1-yl]thiophene-2,4-dicarboxylate
Also Known As: 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate, 2-ethyl 4-methyl 5-{3-[hydroxy(phenyl)amino]-2,5-dioxopyrrolidin-1-yl}thiophene-2,4-dicarboxylate, 2-O-ethyl 4-O-methyl 5-[3-(N-hydroxyanilino)-2,5-dioxopyrrolidin-1-yl]thiophene-2,4-dicarboxylate
| Molecular Formula | C19H18N2O7S |
|---|---|
| Molecular Weight | 418.08 g/mol |
| LogP | 2.2391 |
| Topological Polar Surface Area | 113.45 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 418.08347 |
| Heavy Atoms | 29 |
| Complexity | 956.72217 |
Chemical Identifiers
| CAS Number | 1007927-94-7 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(S1)N2C(=O)CC(C2=O)N(C3=CC=CC=C3)O)C(=O)OC |
Product Overview
2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate (CAS 1007927-94-7), with molecular formula C19H18N2O7S and molecular weight 418.08 g/mol. IUPAC: 2-O-ethyl 4-O-methyl 5-[3-(N-hydroxyanilino)-2,5-dioxopyrrolidin-1-yl]thiophene-2,4-dicarboxylate.
Chemical Property Profile of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate
Property Insights of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate
The XLogP value of 2.2391 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate. The TPSA of 113.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate. Following Lipinski's Rule of Five, 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate has 1 hydrogen bond donor(s) and 9 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 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate?
The CAS number of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate is 1007927-94-7.
What is the molecular formula of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate?
The molecular formula of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate is C19H18N2O7S.
What is the molecular weight of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate?
The molecular weight of 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate is 418.08 g/mol.
Where can I buy 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate?
You can request a quote for 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)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 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-ethyl 4-methyl 5-(3-(hydroxy(phenyl)amino)-2,5-dioxopyrrolidin-1-yl)thiophene-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.