2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)
TL;DR: 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) (CAS 1877-50-5) is a chemical compound with molecular formula C17H28Cl2N2O2 and molecular weight 362.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-diethylphenyl) 2-(4-methylpiperazin-1-yl)acetate;dihydrochloride
Also Known As: 4-Methyl-1-piperazineacetic acid 2,6-diethylphenyl ester dihydrochloride, 2,6-diethylphenyl(4-methylpiperazin-1-yl)acetate dihydrochloride, 1-Piperazineacetic acid, 4-methyl-, 2,6-diethylphenyl ester, dihydrochloride, 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2), (2,6-diethylphenyl) 2-(4-methylpiperazin-1-yl)acetate dihydrochloride
| Molecular Formula | C17H28Cl2N2O2 |
|---|---|
| Molecular Weight | 362.15 g/mol |
| LogP | 2.81 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 362.15277 |
| Heavy Atoms | 23 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 1877-50-5 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)CC)OC(=O)CN2CCN(CC2)C.Cl.Cl |
| InChIKey | DMGIHDLACPMXLL-UHFFFAOYSA-N |
Product Overview
2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) (CAS 1877-50-5), with molecular formula C17H28Cl2N2O2 and molecular weight 362.15 g/mol. IUPAC: (2,6-diethylphenyl) 2-(4-methylpiperazin-1-yl)acetate;dihydrochloride.
Chemical Property Profile of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)
Property Insights of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)
The XLogP value of 2.81 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2). With a topological polar surface area (TPSA) of 32.8 Ų, 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) has 2 hydrogen bond donor(s) and 4 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 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)?
The CAS number of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) is 1877-50-5.
What is the molecular formula of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)?
The molecular formula of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) is C17H28Cl2N2O2.
What is the molecular weight of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)?
The molecular weight of 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) is 362.15 g/mol.
Where can I buy 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)?
You can request a quote for 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2)?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Diethylphenyl (4-methylpiperazin-1-yl)acetate--hydrogen chloride (1/2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.