methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl
TL;DR: methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl (CAS 53828-84-5) is a chemical compound with molecular formula C20H16N2O9S and molecular weight 460.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl)ethenyl]furan-2-carboxylate
Also Known As: methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl, methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl)ethenyl]furan-2-carboxylate, METHYL 5-[(E)-2-(4-ACETAMIDOPHENYL)SULFONYL-2-(5-NITRO-2-FURYL)ETHENYL]FURAN-2-CARBOXYLATE, Methyl 5-[2-(4-acetamidobenzene-1-sulfonyl)-2-(5-nitrofuran-2-yl)ethen-1-yl]furan-2-carboxylate
| Molecular Formula | C20H16N2O9S |
|---|---|
| Molecular Weight | 460.06 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 460.05765 |
| Heavy Atoms | 32 |
| Complexity | 853.0 |
Chemical Identifiers
| CAS Number | 53828-84-5 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)C(=CC2=CC=C(O2)C(=O)OC)C3=CC=C(O3)[N+](=O)[O-] |
| InChIKey | JWZVKXBMKRDFNU-UHFFFAOYSA-N |
Product Overview
methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl (CAS 53828-84-5), with molecular formula C20H16N2O9S and molecular weight 460.06 g/mol. IUPAC: methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl)ethenyl]furan-2-carboxylate.
Chemical Property Profile of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl
Property Insights of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl. The TPSA of 170.0 Ų indicates high polarity, suggesting methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl 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 methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl?
The CAS number of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl is 53828-84-5.
What is the molecular formula of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl?
The molecular formula of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl is C20H16N2O9S.
What is the molecular weight of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl?
The molecular weight of methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl is 460.06 g/mol.
Where can I buy methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl?
You can request a quote for methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl?
Yes, KEHONG BIO provides custom synthesis services for methyl 5-[2-(4-acetamidophenyl)sulfonyl-2-(5-nitrofuran-2-yl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.