Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate
TL;DR: Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate (CAS 6594-84-9) is a chemical compound with molecular formula C17H24N2O6 and molecular weight 352.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate
Also Known As: BAS 01130431, ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate, 4-(3,4,5-Trimethoxy-benzoyl)-piperazine-1-carboxylic acid ethyl ester, ethyl 4-[(3,4,5-trimethoxyphenyl)carbonyl]piperazine-1-carboxylate, ethyl 4-[(3,4,5-trimethoxyphenyl)carbonyl]piperazinecarboxylate
| Molecular Formula | C17H24N2O6 |
|---|---|
| Molecular Weight | 352.16 g/mol |
| LogP | 1.6267 |
| Topological Polar Surface Area | 77.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 352.16342 |
| Heavy Atoms | 25 |
| Complexity | 600.55927 |
Chemical Identifiers
| CAS Number | 6594-84-9 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C(=C2)OC)OC)OC |
Product Overview
Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate (CAS 6594-84-9), with molecular formula C17H24N2O6 and molecular weight 352.16 g/mol. IUPAC: ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate.
Chemical Property Profile of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate
Property Insights of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate
The XLogP value of 1.6267 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate. The TPSA of 77.54 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate. Following Lipinski's Rule of Five, Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate has 0 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 Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate?
The CAS number of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate is 6594-84-9.
What is the molecular formula of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate?
The molecular formula of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate is C17H24N2O6.
What is the molecular weight of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate?
The molecular weight of Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate is 352.16 g/mol.
Where can I buy Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate?
You can request a quote for Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(3,4,5-trimethoxybenzoyl)piperazine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.