Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)
TL;DR: Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) (CAS 58357-69-0) is a chemical compound with molecular formula C20H25ClN2O7S and molecular weight 472.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-hydroxybenzenesulfonic acid;piperazine
Also Known As: Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1), 5-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxy-2-hydroxy-benzenesulfonic Acid; Piperazine, 5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-hydroxybenzenesulfonic acid; piperazine, 5-{[2-(4-Chlorophenoxy)-2-methylpropanoyl]oxy}-2-hydroxybenzene-1-sulfonic acid--piperazine (1/1), RefChem:375146
| Molecular Formula | C20H25ClN2O7S |
|---|---|
| Molecular Weight | 472.11 g/mol |
| LogP | 2.2345 |
| Topological Polar Surface Area | 134.19 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 472.1071 |
| Heavy Atoms | 31 |
| Complexity | 979.5782 |
Chemical Identifiers
| CAS Number | 58357-69-0 |
|---|---|
| SMILES | CC(C)(C(=O)OC1=CC(=C(C=C1)O)S(=O)(=O)O)OC2=CC=C(C=C2)Cl.C1CNCCN1 |
Product Overview
Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) (CAS 58357-69-0), with molecular formula C20H25ClN2O7S and molecular weight 472.11 g/mol. IUPAC: 5-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-2-hydroxybenzenesulfonic acid;piperazine.
Chemical Property Profile of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)
Property Insights of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)
The XLogP value of 2.2345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1). The TPSA of 134.19 Ų falls within the moderate polarity range, balancing permeability and solubility for Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1). Following Lipinski's Rule of Five, Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) has 4 hydrogen bond donor(s) and 8 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 Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)?
The CAS number of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) is 58357-69-0.
What is the molecular formula of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)?
The molecular formula of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) is C20H25ClN2O7S.
What is the molecular weight of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)?
The molecular weight of Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) is 472.11 g/mol.
Where can I buy Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)?
You can request a quote for Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, 2-(4-chlorophenoxy)-2-methyl-, 4-hydroxy-3-sulfophenyl ester, compd. with piperazine (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.