![Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate structure](/static/products/890/890202-76-3.png)
Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate
TL;DR: Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate (CAS 890202-76-3) is a chemical compound with molecular formula C20H21BrClN3O3 and molecular weight 465.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate
Also Known As: AP-970/43268793, methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate, methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate, METHYL 3-(5-BROMO-2-CHLOROBENZAMIDO)-4-(4-METHYLPIPERAZIN-1-YL)BENZOATE, Methyl 3-[(5-bromo-2-chloro-benzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate
| Molecular Formula | C20H21BrClN3O3 |
|---|---|
| Molecular Weight | 465.05 g/mol |
| LogP | 3.8932 |
| Topological Polar Surface Area | 61.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 465.04547 |
| Heavy Atoms | 28 |
| Complexity | 898.2598 |
Chemical Identifiers
| CAS Number | 890202-76-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=C(C=CC(=C3)Br)Cl |
Product Overview
Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate (CAS 890202-76-3), with molecular formula C20H21BrClN3O3 and molecular weight 465.05 g/mol. IUPAC: methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methylpiperazin-1-yl)benzoate.
Chemical Property Profile of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate
Property Insights of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate
The XLogP value of 3.8932 indicates that Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)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 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate. Following Lipinski's Rule of Five, Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)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 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate?
The CAS number of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate is 890202-76-3.
What is the molecular formula of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate?
The molecular formula of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate is C20H21BrClN3O3.
What is the molecular weight of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate?
The molecular weight of Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate is 465.05 g/mol.
Where can I buy Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate?
You can request a quote for Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(5-bromo-2-chlorobenzoyl)amino]-4-(4-methyl-1-piperazinyl)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.