1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine
TL;DR: 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine (CAS 429623-47-2) is a chemical compound with molecular formula C14H21FN2O2S and molecular weight 300.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-fluorophenyl)methyl]-4-propylsulfonylpiperazine
Also Known As: BAS 03152631, 1-(4-fluorobenzyl)-4-(propylsulfonyl)piperazine, 1-[(4-fluorophenyl)methyl]-4-propylsulfonylpiperazine, 1-(4-Fluoro-benzyl)-4-(propane-1-sulfonyl)-piperazine, 4-[(4-fluorophenyl)methyl]-1-(propylsulfonyl)piperazine
| Molecular Formula | C14H21FN2O2S |
|---|---|
| Molecular Weight | 300.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 49.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.13077 |
| Heavy Atoms | 20 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 429623-47-2 |
|---|---|
| SMILES | CCCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)F |
| InChIKey | ZCULFEKBSDLKAU-UHFFFAOYSA-N |
Product Overview
1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine (CAS 429623-47-2), with molecular formula C14H21FN2O2S and molecular weight 300.13 g/mol. IUPAC: 1-[(4-fluorophenyl)methyl]-4-propylsulfonylpiperazine.
Chemical Property Profile of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine
Property Insights of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine. With a topological polar surface area (TPSA) of 49.0 Ų, 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine 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 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine?
The CAS number of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine is 429623-47-2.
What is the molecular formula of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine?
The molecular formula of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine is C14H21FN2O2S.
What is the molecular weight of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine?
The molecular weight of 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine is 300.13 g/mol.
Where can I buy 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine?
You can request a quote for 1-(4-Fluorobenzyl)-4-(propylsulfonyl)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-Fluorobenzyl)-4-(propylsulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorobenzyl)-4-(propylsulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.