Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate
TL;DR: Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate (CAS 890281-18-2) is a chemical compound with molecular formula C14H20N2O4S and molecular weight 312.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate
Also Known As: Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate, ethyl 2-[4-(phenylsulfonyl)piperazinyl]acetate, ethyl [4-(phenylsulfonyl)piperazin-1-yl]acetate, Ethyl2-[4-(benzenesulfonyl)piperazin-1-yl]acetate, ethyl 2-(4-(benzenesulfonyl)piperazin-1-yl)acetate
| Molecular Formula | C14H20N2O4S |
|---|---|
| Molecular Weight | 312.11 g/mol |
| LogP | 0.556 |
| Topological Polar Surface Area | 66.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.11438 |
| Heavy Atoms | 21 |
| Complexity | 565.8966 |
Chemical Identifiers
| CAS Number | 890281-18-2 |
|---|---|
| SMILES | CCOC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2 |
Product Overview
Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate (CAS 890281-18-2), with molecular formula C14H20N2O4S and molecular weight 312.11 g/mol. IUPAC: ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate.
Chemical Property Profile of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate
Property Insights of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate
The XLogP value of 0.556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate. The TPSA of 66.92 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate. Following Lipinski's Rule of Five, Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate has 0 hydrogen bond donor(s) and 5 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 Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate?
The CAS number of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate is 890281-18-2.
What is the molecular formula of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate?
The molecular formula of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate is C14H20N2O4S.
What is the molecular weight of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate?
The molecular weight of Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate is 312.11 g/mol.
Where can I buy Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate?
You can request a quote for Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[4-(benzenesulfonyl)piperazin-1-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.