BAS 04443562
TL;DR: BAS 04443562 (CAS 524675-89-6) is a chemical compound with molecular formula C21H25ClN2O5 and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenoxy)-1-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone
Also Known As: BAS 04443562, AT-057/43318693, 2-(4-chlorophenoxy)-1-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone, 4-({4-[(4-chlorophenoxy)acetyl]-1-piperazinyl}methyl)-2,6-dimethoxyphenol, 2-(4-chlorophenoxy)-1-[4-(4-hydroxy-3,5-dimethoxybenzyl)piperazin-1-yl]ethanone
| Molecular Formula | C21H25ClN2O5 |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 2.786 |
| Topological Polar Surface Area | 71.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 420.1452 |
| Heavy Atoms | 29 |
| Complexity | 810.46027 |
Chemical Identifiers
| CAS Number | 524675-89-6 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)CN2CCN(CC2)C(=O)COC3=CC=C(C=C3)Cl |
Product Overview
BAS 04443562 (CAS 524675-89-6), with molecular formula C21H25ClN2O5 and molecular weight 420.15 g/mol. IUPAC: 2-(4-chlorophenoxy)-1-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]ethanone.
Chemical Property Profile of BAS 04443562
Property Insights of BAS 04443562
The XLogP value of 2.786 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 04443562. The TPSA of 71.47 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04443562. Following Lipinski's Rule of Five, BAS 04443562 has 1 hydrogen bond donor(s) and 6 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 BAS 04443562?
The CAS number of BAS 04443562 is 524675-89-6.
What is the molecular formula of BAS 04443562?
The molecular formula of BAS 04443562 is C21H25ClN2O5.
What is the molecular weight of BAS 04443562?
The molecular weight of BAS 04443562 is 420.15 g/mol.
Where can I buy BAS 04443562?
You can request a quote for BAS 04443562 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04443562?
Yes, KEHONG BIO provides custom synthesis services for BAS 04443562 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.