![2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one structure](/static/products/158/158939-09-4.webp)
2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one
TL;DR: 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one (CAS 158939-09-4) is a chemical compound with molecular formula C12H14ClFN2O3S and molecular weight 320.03976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone
Also Known As: 1-(chloroacetyl)-4-[(4-fluorophenyl)sulfonyl]piperazine, 2-chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one, UPCMLD0ENAT5590536:001, 2-chloro-1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethanone, 2-CHLORO-1-[4-(4-FLUOROBENZENESULFONYL)PIPERAZIN-1-YL]ETHANONE
Technical Specifications
| Molecular Formula | C12H14ClFN2O3S |
| Molecular Weight | 320.03976 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.03976 Da |
| Heavy Atoms | 20 |
| Complexity | 438.0 |
| SMILES | C1CN(CCN1C(=O)CCl)S(=O)(=O)C2=CC=C(C=C2)F |
| InChIKey | NVNPFTFEZGDPTO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one
Property Insights of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one. The TPSA of 66.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one. Following Lipinski's Rule of Five, 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one 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
What is the CAS number of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one?
The CAS number of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one is 158939-09-4.
What is the molecular formula of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one?
The molecular formula of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one is C12H14ClFN2O3S.
What is the molecular weight of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one?
The molecular weight of 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one is 320.03976 g/mol.
Where can I buy 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one?
You can request a quote for 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 2-Chloro-1-[4-(4-fluorobenzenesulfonyl)piperazin-1-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.