1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride
TL;DR: 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride (CAS 68061-03-0) is a chemical compound with molecular formula C15H23ClN2O5 and molecular weight 346.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4,5-trimethoxyphenyl) 4-methylpiperazine-1-carboxylate;hydrochloride
Also Known As: 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride, 3,4,5-Trimethoxyphenyl 4-methyl-1-piperazinecarboxylate monohydrochloride, (3,4,5-trimethoxyphenyl) 4-methylpiperazine-1-carboxylate hydrochloride, 3,4,5-Trimethoxyphenyl 4-methylpiperazine-1-carboxylate--hydrogen chloride (1/1), RefChem:233654
| Molecular Formula | C15H23ClN2O5 |
|---|---|
| Molecular Weight | 346.13 g/mol |
| LogP | 1.8804 |
| Topological Polar Surface Area | 60.47 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 346.12955 |
| Heavy Atoms | 23 |
| Complexity | 507.5937 |
Chemical Identifiers
| CAS Number | 68061-03-0 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)OC2=CC(=C(C(=C2)OC)OC)OC.Cl |
Product Overview
1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride (CAS 68061-03-0), with molecular formula C15H23ClN2O5 and molecular weight 346.13 g/mol. IUPAC: (3,4,5-trimethoxyphenyl) 4-methylpiperazine-1-carboxylate;hydrochloride.
Chemical Property Profile of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride
Property Insights of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride
The XLogP value of 1.8804 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride. The TPSA of 60.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride. Following Lipinski's Rule of Five, 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride 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 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride?
The CAS number of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride is 68061-03-0.
What is the molecular formula of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride?
The molecular formula of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride is C15H23ClN2O5.
What is the molecular weight of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride?
The molecular weight of 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride is 346.13 g/mol.
Where can I buy 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride?
You can request a quote for 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperazinecarboxylic acid, 4-methyl-, 3,4,5-trimethoxyphenyl ester, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.