![[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate structure](/static/products/7910/791093-55-5.webp)
[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate
TL;DR: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate (CAS 791093-55-5) is a chemical compound with molecular formula C20H18N4O7S and molecular weight 458.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate
Also Known As: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate|[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate|EN300-26613490
| Molecular Formula | C20H18N4O7S |
|---|---|
| Molecular Weight | 458.09 g/mol |
| LogP | 2.58672 |
| Topological Polar Surface Area | 154.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 458.08963 |
| Heavy Atoms | 32 |
| Complexity | 1233.7125 |
Chemical Identifiers
| CAS Number | 791093-55-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C=C/S(=O)(=O)NCC(=O)OCC2=NN=C(O2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate (CAS 791093-55-5), with molecular formula C20H18N4O7S and molecular weight 458.09 g/mol. IUPAC: [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate.
Chemical Property Profile of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate
Property Insights of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate
The XLogP value of 2.58672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate. The TPSA of 154.53 Ų indicates high polarity, suggesting [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate 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 [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate?
The CAS number of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate is 791093-55-5.
What is the molecular formula of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate?
The molecular formula of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate is C20H18N4O7S.
What is the molecular weight of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate?
The molecular weight of [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate is 458.09 g/mol.
Where can I buy [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate?
You can request a quote for [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate?
Yes, KEHONG BIO provides custom synthesis services for [5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methyl 2-[2-(4-methylphenyl)ethenesulfonamido]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.