1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine
TL;DR: 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine (CAS 398996-74-2) is a chemical compound with molecular formula C21H27FN2O3S and molecular weight 406.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenyl)-4-(2-methoxy-4-methyl-5-propan-2-ylphenyl)sulfonylpiperazine
Also Known As: VU0488772-1, F0838-0391, 1-(4-fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine, 1-(4-fluorophenyl)-4-[2-methoxy-4-methyl-5-(propan-2-yl)benzenesulfonyl]piperazine, 1-(4-fluorophenyl)-4-(2-methoxy-4-methyl-5-propan-2-ylphenyl)sulfonylpiperazine
| Molecular Formula | C21H27FN2O3S |
|---|---|
| Molecular Weight | 406.17 g/mol |
| LogP | 3.77702 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.17264 |
| Heavy Atoms | 28 |
| Complexity | 934.8682 |
Chemical Identifiers
| CAS Number | 398996-74-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C(C)C)S(=O)(=O)N2CCN(CC2)C3=CC=C(C=C3)F)OC |
Product Overview
1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine (CAS 398996-74-2), with molecular formula C21H27FN2O3S and molecular weight 406.17 g/mol. IUPAC: 1-(4-fluorophenyl)-4-(2-methoxy-4-methyl-5-propan-2-ylphenyl)sulfonylpiperazine.
Chemical Property Profile of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine
Property Insights of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine
The XLogP value of 3.77702 indicates that 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine has 0 hydrogen bond donor(s) and 4 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-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine?
The CAS number of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine is 398996-74-2.
What is the molecular formula of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine?
The molecular formula of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine is C21H27FN2O3S.
What is the molecular weight of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine?
The molecular weight of 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine is 406.17 g/mol.
Where can I buy 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine?
You can request a quote for 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenyl)-4-((5-isopropyl-2-methoxy-4-methylphenyl)sulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.