1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine
TL;DR: 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine (CAS 459176-98-8) is a chemical compound with molecular formula C13H18BrNO3S and molecular weight 347.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-bromo-2-methoxyphenyl)sulfonyl-4-methylpiperidine
Also Known As: 1-((5-bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine, BAS 01549614, 1-(5-bromo-2-methoxyphenyl)sulfonyl-4-methylpiperidine, AP-263/13383314, 1-(5-Bromo-2-methoxy-benzenesulfonyl)-4-methyl-piperidine
| Molecular Formula | C13H18BrNO3S |
|---|---|
| Molecular Weight | 347.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 55.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.01907 |
| Heavy Atoms | 19 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 459176-98-8 |
|---|---|
| SMILES | CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)Br)OC |
| InChIKey | PFTPUTRVKLIAAV-UHFFFAOYSA-N |
Product Overview
1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine (CAS 459176-98-8), with molecular formula C13H18BrNO3S and molecular weight 347.02 g/mol. IUPAC: 1-(5-bromo-2-methoxyphenyl)sulfonyl-4-methylpiperidine.
Chemical Property Profile of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine
Property Insights of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine
The XLogP value of 3.0 indicates that 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.0 Ų, 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine 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 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine?
The CAS number of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine is 459176-98-8.
What is the molecular formula of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine?
The molecular formula of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine is C13H18BrNO3S.
What is the molecular weight of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine?
The molecular weight of 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine is 347.02 g/mol.
Where can I buy 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine?
You can request a quote for 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-((5-Bromo-2-methoxyphenyl)sulfonyl)-4-methylpiperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.