Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate
TL;DR: Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate (CAS 765919-89-9) is a chemical compound with molecular formula C22H27N3O3 and molecular weight 381.21 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-[(4-methylbenzoyl)amino]benzoate
Also Known As: Methyl 4-(4-ethylpiperazin-1-yl)-3-[(4-methylbenzoyl)amino]benzoate, METHYL 4-(4-ETHYLPIPERAZIN-1-YL)-3-(4-METHYLBENZAMIDO)BENZOATE, methyl 4-(4-ethylpiperazin-1-yl)-3-{[(4-methylphenyl)carbonyl]amino}benzoate
| Molecular Formula | C22H27N3O3 |
|---|---|
| Molecular Weight | 381.21 g/mol |
| LogP | 3.17582 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.20523 |
| Heavy Atoms | 28 |
| Complexity | 840.6055 |
Chemical Identifiers
| CAS Number | 765919-89-9 |
|---|---|
| SMILES | CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC=C(C=C3)C |
Product Overview
Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate (CAS 765919-89-9), with molecular formula C22H27N3O3 and molecular weight 381.21 g/mol. IUPAC: methyl 4-(4-ethylpiperazin-1-yl)-3-[(4-methylbenzoyl)amino]benzoate.
Chemical Property Profile of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate
Property Insights of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate
The XLogP value of 3.17582 indicates that Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.88 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate. Following Lipinski's Rule of Five, Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate 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 Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate?
The CAS number of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate is 765919-89-9.
What is the molecular formula of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate?
The molecular formula of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate is C22H27N3O3.
What is the molecular weight of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate?
The molecular weight of Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate is 381.21 g/mol.
Where can I buy Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate?
You can request a quote for Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)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-methylbenzamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(4-ethylpiperazin-1-YL)-3-(4-methylbenzamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.