2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine
TL;DR: 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine (CAS 331256-12-3) 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.
2-methyl-1-(2-nitrophenyl)sulfonylpiperidine
Also Known As: 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine, BAS 00356590, BIM-0048043.P001, Piperidine, 2-methyl-1-[(2-nitrophenyl)sulfonyl]-, 2-methyl-1-(2-nitrophenyl)sulfonylpiperidine
| Molecular Formula | C12H16N2O4S |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 2.1579 |
| 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 | 585.1471 |
Chemical Identifiers
| CAS Number | 331256-12-3 |
|---|---|
| SMILES | CC1CCCCN1S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-] |
Product Overview
2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine (CAS 331256-12-3), with molecular formula C12H16N2O4S and molecular weight 284.08 g/mol. IUPAC: 2-methyl-1-(2-nitrophenyl)sulfonylpiperidine.
Chemical Property Profile of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine
Property Insights of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine
The XLogP value of 2.1579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine. Following Lipinski's Rule of Five, 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine 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 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine?
The CAS number of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine is 331256-12-3.
What is the molecular formula of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine?
The molecular formula of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine is C12H16N2O4S.
What is the molecular weight of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine?
The molecular weight of 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine is 284.08 g/mol.
Where can I buy 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine?
You can request a quote for 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-(2-nitro-benzenesulfonyl)-piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.