![2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione structure](/static/products/4426/442654-80-0.webp)
2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione
TL;DR: 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione (CAS 442654-80-0) is a chemical compound with molecular formula C20H16BrClN2O4S and molecular weight 493.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione
Also Known As: AH-487/41188954, 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione, 2-{4-[(4-bromophenyl)sulfonyl]-1-piperazinyl}-3-chloronaphthoquinone, 2-{4-[(4-bromophenyl)sulfonyl]piperazin-1-yl}-3-chloronaphthalene-1,4-dione, 2-[4-(4-BROMOBENZENESULFONYL)PIPERAZIN-1-YL]-3-CHLORO-1,4-DIHYDRONAPHTHALENE-1,4-DIONE
| Molecular Formula | C20H16BrClN2O4S |
|---|---|
| Molecular Weight | 493.97 g/mol |
| LogP | 3.285 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 493.97028 |
| Heavy Atoms | 29 |
| Complexity | 1137.326 |
Chemical Identifiers
| CAS Number | 442654-80-0 |
|---|---|
| SMILES | C1CN(CCN1C2=C(C(=O)C3=CC=CC=C3C2=O)Cl)S(=O)(=O)C4=CC=C(C=C4)Br |
Product Overview
2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione (CAS 442654-80-0), with molecular formula C20H16BrClN2O4S and molecular weight 493.97 g/mol. IUPAC: 2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione.
Chemical Property Profile of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione
Property Insights of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione
The XLogP value of 3.285 indicates that 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione. Following Lipinski's Rule of Five, 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione has 0 hydrogen bond donor(s) and 5 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-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione?
The CAS number of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione is 442654-80-0.
What is the molecular formula of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione?
The molecular formula of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione is C20H16BrClN2O4S.
What is the molecular weight of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione?
The molecular weight of 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione is 493.97 g/mol.
Where can I buy 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione?
You can request a quote for 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(4-Bromophenyl)sulfonylpiperazin-1-yl]-3-chloronaphthalene-1,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.