![Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride structure](/static/products/851/85126-73-4.png)
Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride
TL;DR: Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride (CAS 85126-73-4) 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-[(2-piperazin-1-ylacetyl)amino]benzoate
Also Known As: Methyl 4-(2-(piperazin-1-yl)acetamido)benzoate, methyl 4-[(2-piperazin-1-ylacetyl)amino]benzoate, methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride, methyl 4-[(piperazin-1-ylacetyl)amino]benzoate, p-methoxycarbonyl-alpha-(1-piperazinyl)acetanilide
| Molecular Formula | C14H19N3O3 |
|---|---|
| Molecular Weight | 277.14 g/mol |
| LogP | 0.3169 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.14264 |
| Heavy Atoms | 20 |
| Complexity | 467.0574 |
Chemical Identifiers
| CAS Number | 85126-73-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)NC(=O)CN2CCNCC2 |
Product Overview
Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride (CAS 85126-73-4), with molecular formula C14H19N3O3 and molecular weight 277.14 g/mol. IUPAC: methyl 4-[(2-piperazin-1-ylacetyl)amino]benzoate.
Chemical Property Profile of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride
Property Insights of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride
The XLogP value of 0.3169 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride. Following Lipinski's Rule of Five, Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride has 2 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-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride?
The CAS number of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride is 85126-73-4.
What is the molecular formula of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride?
The molecular formula of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride is C14H19N3O3.
What is the molecular weight of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride?
The molecular weight of Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride is 277.14 g/mol.
Where can I buy Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride?
You can request a quote for Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[(piperazin-1-ylacetyl)amino]benzoate dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.