1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol
TL;DR: 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol (CAS 796126-11-9) is a chemical compound with molecular formula C21H25FN2O4S and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-fluorophenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-2-ol
Also Known As: 1-(2-fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol, 1-(2-fluorophenoxy)-3-[4-(2-phenylethenylsulfonyl)piperazin-1-yl]propan-2-ol, 1-(2-fluorophenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-2-ol
| Molecular Formula | C21H25FN2O4S |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 2.1837 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 420.15192 |
| Heavy Atoms | 29 |
| Complexity | 913.28815 |
Chemical Identifiers
| CAS Number | 796126-11-9 |
|---|---|
| SMILES | C1CN(CCN1CC(COC2=CC=CC=C2F)O)S(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol (CAS 796126-11-9), with molecular formula C21H25FN2O4S and molecular weight 420.15 g/mol. IUPAC: 1-(2-fluorophenoxy)-3-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]propan-2-ol.
Chemical Property Profile of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol
Property Insights of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol
The XLogP value of 2.1837 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol. Following Lipinski's Rule of Five, 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol has 1 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-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol?
The CAS number of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol is 796126-11-9.
What is the molecular formula of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol?
The molecular formula of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol is C21H25FN2O4S.
What is the molecular weight of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol?
The molecular weight of 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol is 420.15 g/mol.
Where can I buy 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol?
You can request a quote for 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Fluorophenoxy)-3-[4-(2-phenylethenesulfonyl)piperazin-1-yl]propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.