Naphthyl 4-(phenylsulfonyl)piperazinyl ketone
TL;DR: Naphthyl 4-(phenylsulfonyl)piperazinyl ketone (CAS 333756-95-9) is a chemical compound with molecular formula C21H20N2O3S and molecular weight 380.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(benzenesulfonyl)piperazin-1-yl]-naphthalen-1-ylmethanone
Also Known As: BAS 03050042, naphthyl 4-(phenylsulfonyl)piperazinyl ketone, 1-(1-naphthoyl)-4-(phenylsulfonyl)piperazine, AT-057/43313960, [4-(benzenesulfonyl)piperazin-1-yl]-naphthalen-1-ylmethanone
| Molecular Formula | C21H20N2O3S |
|---|---|
| Molecular Weight | 380.12 g/mol |
| LogP | 2.9865 |
| Topological Polar Surface Area | 57.69 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.11948 |
| Heavy Atoms | 27 |
| Complexity | 1067.5417 |
Chemical Identifiers
| CAS Number | 333756-95-9 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC=CC3=CC=CC=C32)S(=O)(=O)C4=CC=CC=C4 |
Product Overview
Naphthyl 4-(phenylsulfonyl)piperazinyl ketone (CAS 333756-95-9), with molecular formula C21H20N2O3S and molecular weight 380.12 g/mol. IUPAC: [4-(benzenesulfonyl)piperazin-1-yl]-naphthalen-1-ylmethanone.
Chemical Property Profile of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone
Property Insights of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone
The XLogP value of 2.9865 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Naphthyl 4-(phenylsulfonyl)piperazinyl ketone. With a topological polar surface area (TPSA) of 57.69 Ų, Naphthyl 4-(phenylsulfonyl)piperazinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthyl 4-(phenylsulfonyl)piperazinyl 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 Naphthyl 4-(phenylsulfonyl)piperazinyl ketone?
The CAS number of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone is 333756-95-9.
What is the molecular formula of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone?
The molecular formula of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone is C21H20N2O3S.
What is the molecular weight of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone?
The molecular weight of Naphthyl 4-(phenylsulfonyl)piperazinyl ketone is 380.12 g/mol.
Where can I buy Naphthyl 4-(phenylsulfonyl)piperazinyl ketone?
You can request a quote for Naphthyl 4-(phenylsulfonyl)piperazinyl ketone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthyl 4-(phenylsulfonyl)piperazinyl ketone?
Yes, KEHONG BIO provides custom synthesis services for Naphthyl 4-(phenylsulfonyl)piperazinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.