ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate
TL;DR: ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate (CAS 385394-02-5) is a chemical compound with molecular formula C25H26N4O7S and molecular weight 526.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[(4-acetamidophenyl)sulfonylamino]-1,4-dioxonaphthalen-2-yl]piperazine-1-carboxylate
Also Known As: ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate, ethyl 4-[3-({[4-(acetylamino)phenyl]sulfonyl}amino)-1,4-dioxo-1,4-dihydronaphthalen-2-yl]piperazine-1-carboxylate, Ethyl 4-[3-[(4-acetamidophenyl)sulfonylamino]-1,4-dioxo-naphthalen-2-yl]piperazine-1-carboxylate, ethyl 4-[3-[(4-acetamidophenyl)sulfonylamino]-1,4-dioxonaphthalen-2-yl]piperazine-1-carboxylate
| Molecular Formula | C25H26N4O7S |
|---|---|
| Molecular Weight | 526.15 g/mol |
| LogP | 1.9882 |
| Topological Polar Surface Area | 142.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 526.1522 |
| Heavy Atoms | 37 |
| Complexity | 1392.3735 |
Chemical Identifiers
| CAS Number | 385394-02-5 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)NC(=O)C |
Product Overview
ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate (CAS 385394-02-5), with molecular formula C25H26N4O7S and molecular weight 526.15 g/mol. IUPAC: ethyl 4-[3-[(4-acetamidophenyl)sulfonylamino]-1,4-dioxonaphthalen-2-yl]piperazine-1-carboxylate.
Chemical Property Profile of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate
Property Insights of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate
The XLogP value of 1.9882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate. The TPSA of 142.19 Ų indicates high polarity, suggesting ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate?
The CAS number of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate is 385394-02-5.
What is the molecular formula of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate?
The molecular formula of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate is C25H26N4O7S.
What is the molecular weight of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate?
The molecular weight of ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate is 526.15 g/mol.
Where can I buy ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate?
You can request a quote for ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(3-(4-acetamidophenylsulfonamido)-1,4-dioxo-1,4-dihydronaphthalen-2-yl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.