Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate
TL;DR: Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate (CAS 767316-73-4) is a chemical compound with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate
Also Known As: methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate, 4- -3-amino-benzoicacidmethylester, 4-(4-Acetyl-1-piperazinyl)-3-amino-benzoic acid methyl ester, BB 0245806, 2-Chloro-N-(4-diethylsulfamoyl-phenyl)-acetamide
| Molecular Formula | C14H19N3O3 |
|---|---|
| Molecular Weight | 277.14 g/mol |
| LogP | 0.7239 |
| Topological Polar Surface Area | 75.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.14264 |
| Heavy Atoms | 20 |
| Complexity | 522.39545 |
Chemical Identifiers
| CAS Number | 767316-73-4 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)N |
Product Overview
Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate (CAS 767316-73-4), with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol. IUPAC: methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate.
Chemical Property Profile of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate
Property Insights of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate
The XLogP value of 0.7239 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate. The TPSA of 75.87 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate. Following Lipinski's Rule of Five, Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate 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-acetylpiperazin-1-yl)-3-aminobenzoate?
The CAS number of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate is 767316-73-4.
What is the molecular formula of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate?
The molecular formula of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate is C14H19N3O3.
What is the molecular weight of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate?
The molecular weight of Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate is 277.14 g/mol.
Where can I buy Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate?
You can request a quote for Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate 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-acetylpiperazin-1-yl)-3-aminobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-(4-acetylpiperazin-1-yl)-3-aminobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.