![2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone structure](/static/products/489/489443-22-3.png)
2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone
TL;DR: 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone (CAS 489443-22-3) is a chemical compound with molecular formula C20H24N2O5S and molecular weight 404.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylsulfonylpiperazin-1-yl)-(2,3-dimethoxyphenyl)methanone
Also Known As: BAS 03152909, 2,3-dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone, (4-(benzylsulfonyl)piperazin-1-yl)(2,3-dimethoxyphenyl)methanone, (4-benzylsulfonylpiperazin-1-yl)-(2,3-dimethoxyphenyl)methanone, [4-(benzylsulfonyl)piperazin-1-yl](2,3-dimethoxyphenyl)methanone
| Molecular Formula | C20H24N2O5S |
|---|---|
| Molecular Weight | 404.14 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 84.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 404.1406 |
| Heavy Atoms | 28 |
| Complexity | 607.0 |
Chemical Identifiers
| CAS Number | 489443-22-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3 |
| InChIKey | QBJIKZDHIZPYNE-UHFFFAOYSA-N |
Product Overview
2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone (CAS 489443-22-3), with molecular formula C20H24N2O5S and molecular weight 404.14 g/mol. IUPAC: (4-benzylsulfonylpiperazin-1-yl)-(2,3-dimethoxyphenyl)methanone.
Chemical Property Profile of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone
Property Insights of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone. The TPSA of 84.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone. Following Lipinski's Rule of Five, 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone has 0 hydrogen bond donor(s) and 6 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 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone?
The CAS number of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone is 489443-22-3.
What is the molecular formula of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone?
The molecular formula of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone is C20H24N2O5S.
What is the molecular weight of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone?
The molecular weight of 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone is 404.14 g/mol.
Where can I buy 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone?
You can request a quote for 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethoxyphenyl 4-[benzylsulfonyl]piperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.