8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline
TL;DR: 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline (CAS 347356-14-3) is a chemical compound with molecular formula C20H20N4O4S and molecular weight 412.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline
Also Known As: 5-Nitro-8-(4-tosylpiperazin-1-yl)quinoline, AB00542257-06, 8-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline, 8-{4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}-5-nitroquinoline, 5-nitro-8-{4-[(4-methylphenyl)sulfonyl]-1-piperazinyl}quinoline
| Molecular Formula | C20H20N4O4S |
|---|---|
| Molecular Weight | 412.12 g/mol |
| LogP | 2.96232 |
| Topological Polar Surface Area | 96.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.1205 |
| Heavy Atoms | 29 |
| Complexity | 1170.8104 |
Chemical Identifiers
| CAS Number | 347356-14-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=N4 |
Product Overview
8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline (CAS 347356-14-3), with molecular formula C20H20N4O4S and molecular weight 412.12 g/mol. IUPAC: 8-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline.
Chemical Property Profile of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline
Property Insights of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline
The XLogP value of 2.96232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline. The TPSA of 96.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline. Following Lipinski's Rule of Five, 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline has 0 hydrogen bond donor(s) and 6 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 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline?
The CAS number of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline is 347356-14-3.
What is the molecular formula of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline?
The molecular formula of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline is C20H20N4O4S.
What is the molecular weight of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline?
The molecular weight of 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline is 412.12 g/mol.
Where can I buy 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline?
You can request a quote for 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-5-nitroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.