8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline
TL;DR: 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline (CAS 330634-07-6) is a chemical compound with molecular formula C14H16N4O4S and molecular weight 336.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(4-methylsulfonylpiperazin-1-yl)-5-nitroquinoline
Also Known As: BIM-0032794.P001, 8-(4-methylsulfonylpiperazin-1-yl)-5-nitroquinoline, 1-(methylsulfonyl)-4-(5-nitro(8-quinolyl))piperazine, 5-nitro-8-[4-(methylsulfonyl)-1-piperazinyl]quinoline, 8-(4-(methylsulfonyl)piperazin-1-yl)-5-nitroquinoline
| Molecular Formula | C14H16N4O4S |
|---|---|
| Molecular Weight | 336.09 g/mol |
| LogP | 1.2246 |
| Topological Polar Surface Area | 96.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 336.08923 |
| Heavy Atoms | 23 |
| Complexity | 860.20636 |
Chemical Identifiers
| CAS Number | 330634-07-6 |
|---|---|
| SMILES | CS(=O)(=O)N1CCN(CC1)C2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3 |
Product Overview
8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline (CAS 330634-07-6), with molecular formula C14H16N4O4S and molecular weight 336.09 g/mol. IUPAC: 8-(4-methylsulfonylpiperazin-1-yl)-5-nitroquinoline.
Chemical Property Profile of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline
Property Insights of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline
The XLogP value of 1.2246 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline. The TPSA of 96.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline. Following Lipinski's Rule of Five, 8-(4-Methylsulfonylpiperazin-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-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline?
The CAS number of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline is 330634-07-6.
What is the molecular formula of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline?
The molecular formula of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline is C14H16N4O4S.
What is the molecular weight of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline?
The molecular weight of 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline is 336.09 g/mol.
Where can I buy 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline?
You can request a quote for 8-(4-Methylsulfonylpiperazin-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-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 8-(4-Methylsulfonylpiperazin-1-yl)-5-nitroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.