Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate
TL;DR: Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate (CAS 765920-01-2) is a chemical compound with molecular formula C23H29N3O4 and molecular weight 411.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(4-methylphenoxy)acetyl]amino]benzoate
Also Known As: methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate, AP-970/43482502, methyl 4-(4-ethyl-1-piperazinyl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate, Methyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(4-methylphenoxy)acetyl]amino]benzoate, METHYL 4-(4-ETHYLPIPERAZIN-1-YL)-3-[2-(4-METHYLPHENOXY)ACETAMIDO]BENZOATE
| Molecular Formula | C23H29N3O4 |
|---|---|
| Molecular Weight | 411.22 g/mol |
| LogP | 2.94102 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.21582 |
| Heavy Atoms | 30 |
| Complexity | 874.51697 |
Chemical Identifiers
| CAS Number | 765920-01-2 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)COC3=CC=C(C=C3)C |
Product Overview
Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate (CAS 765920-01-2), with molecular formula C23H29N3O4 and molecular weight 411.22 g/mol. IUPAC: methyl 4-(4-ethylpiperazin-1-yl)-3-[[2-(4-methylphenoxy)acetyl]amino]benzoate.
Chemical Property Profile of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate
Property Insights of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate
The XLogP value of 2.94102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate. The TPSA of 71.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate. Following Lipinski's Rule of Five, Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate 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 Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate?
The CAS number of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate is 765920-01-2.
What is the molecular formula of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate?
The molecular formula of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate is C23H29N3O4.
What is the molecular weight of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate?
The molecular weight of Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate is 411.22 g/mol.
Where can I buy Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate?
You can request a quote for Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenoxy)acetyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.