![4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone structure](/static/products/6944/694473-68-2.webp)
4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone
TL;DR: 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone (CAS 694473-68-2) is a chemical compound with molecular formula C18H27N3O3S and molecular weight 365.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-piperidin-1-ylmethanone
Also Known As: BAS 06496956, 4-[(3,4-dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone, F1757-0075, [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-piperidin-1-ylmethanone, (4-((3,4-dimethylphenyl)sulfonyl)piperazin-1-yl)(piperidin-1-yl)methanone
| Molecular Formula | C18H27N3O3S |
|---|---|
| Molecular Weight | 365.18 g/mol |
| LogP | 2.21564 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.1773 |
| Heavy Atoms | 25 |
| Complexity | 733.9332 |
Chemical Identifiers
| CAS Number | 694473-68-2 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3)C |
Product Overview
4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone (CAS 694473-68-2), with molecular formula C18H27N3O3S and molecular weight 365.18 g/mol. IUPAC: [4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-piperidin-1-ylmethanone.
Chemical Property Profile of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone
Property Insights of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone
The XLogP value of 2.21564 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone. The TPSA of 60.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone. Following Lipinski's Rule of Five, 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone 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 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone?
The CAS number of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone is 694473-68-2.
What is the molecular formula of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone?
The molecular formula of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone is C18H27N3O3S.
What is the molecular weight of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone?
The molecular weight of 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone is 365.18 g/mol.
Where can I buy 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone?
You can request a quote for 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3,4-Dimethylphenyl)sulfonyl]piperazinyl piperidyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.