4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate
TL;DR: 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate (CAS 327093-29-8) is a chemical compound with molecular formula C22H21N3O6S and molecular weight 455.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl)methyl 1-quinolin-8-ylsulfonylpiperidine-4-carboxylate
Also Known As: 4-nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate, F1012-0035, AF-399/40771638, (4-NITROPHENYL)METHYL 1-(QUINOLINE-8-SULFONYL)PIPERIDINE-4-CARBOXYLATE, (4-nitrophenyl)methyl 1-quinolin-8-ylsulfonylpiperidine-4-carboxylate
| Molecular Formula | C22H21N3O6S |
|---|---|
| Molecular Weight | 455.12 g/mol |
| LogP | 3.2871 |
| Topological Polar Surface Area | 119.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 455.1151 |
| Heavy Atoms | 32 |
| Complexity | 1246.9061 |
Chemical Identifiers
| CAS Number | 327093-29-8 |
|---|---|
| SMILES | C1CN(CCC1C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC4=C3N=CC=C4 |
Product Overview
4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate (CAS 327093-29-8), with molecular formula C22H21N3O6S and molecular weight 455.12 g/mol. IUPAC: (4-nitrophenyl)methyl 1-quinolin-8-ylsulfonylpiperidine-4-carboxylate.
Chemical Property Profile of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate
Property Insights of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate
The XLogP value of 3.2871 indicates that 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate. Following Lipinski's Rule of Five, 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate has 0 hydrogen bond donor(s) and 7 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 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate?
The CAS number of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate is 327093-29-8.
What is the molecular formula of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate?
The molecular formula of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate is C22H21N3O6S.
What is the molecular weight of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate?
The molecular weight of 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate is 455.12 g/mol.
Where can I buy 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate?
You can request a quote for 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-Nitrobenzyl 1-(quinolin-8-ylsulfonyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.