![[2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate structure](/static/products/5595/5595-61-9.webp)
[2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate
TL;DR: [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate (CAS 5595-61-9) is a chemical compound with molecular formula C16H12BrN3O8 and molecular weight 452.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3-nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate
Also Known As: [2-[(3-nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate|(3-nitrobenzoyl)carbamoylmethyl 2-[(5-bromofuran-2-carbonyl)amino]acetate|2-(3-Nitrobenzamido)-2-oxoethyl N-(5-bromofuran-2-carbonyl)glycinate
| Molecular Formula | C16H12BrN3O8 |
|---|---|
| Molecular Weight | 452.98 g/mol |
| LogP | 1.1799 |
| Topological Polar Surface Area | 157.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.98077 |
| Heavy Atoms | 28 |
| Complexity | 939.4755 |
Chemical Identifiers
| CAS Number | 5595-61-9 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC(=O)COC(=O)CNC(=O)C2=CC=C(O2)Br |
Product Overview
[2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate (CAS 5595-61-9), with molecular formula C16H12BrN3O8 and molecular weight 452.98 g/mol. IUPAC: [2-[(3-nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate.
Chemical Property Profile of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate
Property Insights of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate
The XLogP value of 1.1799 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate. The TPSA of 157.85 Ų indicates high polarity, suggesting [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate has 2 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 [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate?
The CAS number of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate is 5595-61-9.
What is the molecular formula of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate?
The molecular formula of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate is C16H12BrN3O8.
What is the molecular weight of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate?
The molecular weight of [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate is 452.98 g/mol.
Where can I buy [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate?
You can request a quote for [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-[(3-Nitrobenzoyl)amino]-2-oxoethyl] 2-[(5-bromofuran-2-carbonyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.