2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone
TL;DR: 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone (CAS 768290-62-6) is a chemical compound with molecular formula C15H21NO3S and molecular weight 295.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzylsulfonyl-1-(4-methylpiperidin-1-yl)ethanone
Also Known As: BAS 09532870, 2-(benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone, 1-(4-Methyl-piperidin-1-yl)-2-phenylmethanesulfonyl-ethanone, 1-(4-methylpiperidyl)-2-[benzylsulfonyl]ethan-1-one, 2-benzylsulfonyl-1-(4-methylpiperidin-1-yl)ethanone
| Molecular Formula | C15H21NO3S |
|---|---|
| Molecular Weight | 295.12 g/mol |
| LogP | 1.8599 |
| Topological Polar Surface Area | 54.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.1242 |
| Heavy Atoms | 20 |
| Complexity | 545.74115 |
Chemical Identifiers
| CAS Number | 768290-62-6 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)CS(=O)(=O)CC2=CC=CC=C2 |
Product Overview
2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone (CAS 768290-62-6), with molecular formula C15H21NO3S and molecular weight 295.12 g/mol. IUPAC: 2-benzylsulfonyl-1-(4-methylpiperidin-1-yl)ethanone.
Chemical Property Profile of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone
Property Insights of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone
The XLogP value of 1.8599 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone. With a topological polar surface area (TPSA) of 54.45 Ų, 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone has 0 hydrogen bond donor(s) and 3 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-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone?
The CAS number of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone is 768290-62-6.
What is the molecular formula of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone?
The molecular formula of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone is C15H21NO3S.
What is the molecular weight of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone?
The molecular weight of 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone is 295.12 g/mol.
Where can I buy 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone?
You can request a quote for 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzylsulfonyl)-1-(4-methylpiperidin-1-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.