F0559-0049
TL;DR: F0559-0049 (CAS 533869-28-2) is a chemical compound with molecular formula C22H22ClN5O6S and molecular weight 519.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate
Also Known As: F0559-0049, ethyl 4-((4-((5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl)carbamoyl)phenyl)sulfonyl)piperazine-1-carboxylate, ethyl 4-(4-{[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]carbamoyl}benzenesulfonyl)piperazine-1-carboxylate, ethyl 4-[4-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate, 4-ethoxycarbonyl-1-piperazinyl-p-[N-5-(o-chlorophenyl)-1,3,4-oxadiazol-2-ylcarbamoyl]phenyl(oxo)-lambda-sulfaniumolate
| Molecular Formula | C22H22ClN5O6S |
|---|---|
| Molecular Weight | 519.10 g/mol |
| LogP | 3.1051 |
| Topological Polar Surface Area | 134.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 519.09796 |
| Heavy Atoms | 35 |
| Complexity | 1320.1141 |
Chemical Identifiers
| CAS Number | 533869-28-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NN=C(O3)C4=CC=CC=C4Cl |
Product Overview
F0559-0049 (CAS 533869-28-2), with molecular formula C22H22ClN5O6S and molecular weight 519.10 g/mol. IUPAC: ethyl 4-[4-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]carbamoyl]phenyl]sulfonylpiperazine-1-carboxylate.
Chemical Property Profile of F0559-0049
Property Insights of F0559-0049
The XLogP value of 3.1051 indicates that F0559-0049 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 134.94 Ų falls within the moderate polarity range, balancing permeability and solubility for F0559-0049. Following Lipinski's Rule of Five, F0559-0049 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0559-0049?
The CAS number of F0559-0049 is 533869-28-2.
What is the molecular formula of F0559-0049?
The molecular formula of F0559-0049 is C22H22ClN5O6S.
What is the molecular weight of F0559-0049?
The molecular weight of F0559-0049 is 519.10 g/mol.
Where can I buy F0559-0049?
You can request a quote for F0559-0049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0559-0049?
Yes, KEHONG BIO provides custom synthesis services for F0559-0049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.