3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine
TL;DR: 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine (CAS 321970-50-7) is a chemical compound with molecular formula C12H16N2O4S and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(4-nitrophenyl)sulfonylpiperidine
Also Known As: 3-methyl-1-(4-nitrophenyl)sulfonylpiperidine, BAS 00439754, 3-Methyl-1-(4-nitro-benzenesulfonyl)-piperidine, 3-Methyl-1-(4-nitrophenylsulfonyl)piperidine, 1-[(3-methylpiperidyl)sulfonyl]-4-nitrobenzene
| Molecular Formula | C12H16N2O4S |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 2.0154 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 284.08307 |
| Heavy Atoms | 19 |
| Complexity | 567.8971 |
Chemical Identifiers
| CAS Number | 321970-50-7 |
|---|---|
| SMILES | CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine (CAS 321970-50-7), with molecular formula C12H16N2O4S and molecular weight 284.08 g/mol. IUPAC: 3-methyl-1-(4-nitrophenyl)sulfonylpiperidine.
Chemical Property Profile of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine
Property Insights of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine
The XLogP value of 2.0154 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine. Following Lipinski's Rule of Five, 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine has 0 hydrogen bond donor(s) and 4 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 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine?
The CAS number of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine is 321970-50-7.
What is the molecular formula of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine?
The molecular formula of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine is C12H16N2O4S.
What is the molecular weight of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine?
The molecular weight of 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine is 284.08 g/mol.
Where can I buy 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine?
You can request a quote for 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-(4-nitrophenyl)sulfonylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.