1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine
TL;DR: 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine (CAS 496019-97-7) is a chemical compound with molecular formula C18H21FN2O2S and molecular weight 348.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,5-dimethylphenyl)sulfonyl-4-(2-fluorophenyl)piperazine
Also Known As: BAS 04999360, 1-[(2,5-dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine, 1-(2,5-dimethylphenyl)sulfonyl-4-(2-fluorophenyl)piperazine, AP-263/41417900, 1-(2,5-Dimethyl-benzenesulfonyl)-4-(2-fluoro-phenyl)-piperazine
| Molecular Formula | C18H21FN2O2S |
|---|---|
| Molecular Weight | 348.13 g/mol |
| LogP | 2.95344 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.13077 |
| Heavy Atoms | 24 |
| Complexity | 843.8473 |
Chemical Identifiers
| CAS Number | 496019-97-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F |
Product Overview
1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine (CAS 496019-97-7), with molecular formula C18H21FN2O2S and molecular weight 348.13 g/mol. IUPAC: 1-(2,5-dimethylphenyl)sulfonyl-4-(2-fluorophenyl)piperazine.
Chemical Property Profile of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine
Property Insights of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine
The XLogP value of 2.95344 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine. With a topological polar surface area (TPSA) of 40.62 Ų, 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine 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 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine?
The CAS number of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine is 496019-97-7.
What is the molecular formula of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine?
The molecular formula of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine is C18H21FN2O2S.
What is the molecular weight of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine?
The molecular weight of 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine is 348.13 g/mol.
Where can I buy 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine?
You can request a quote for 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[(2,5-Dimethylphenyl)sulfonyl]-4-(2-fluorophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.