4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride
TL;DR: 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride (CAS 114000-42-9) is a chemical compound with molecular formula C22H30Cl2N2O3 and molecular weight 440.16336 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(4-methylpiperazin-1-yl)-1-phenylethyl] 2-ethoxybenzoate;dihydrochloride
Also Known As: 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride, Benzoic acid, o-ethoxy-, alpha-(4-methyl-1-piperazinylmethyl)benzyl ester, dihydrochloride, 1-Piperazineethanol, 4-methyl-alpha-phenyl-, o-ethoxybenzoate (ester), dihydrochloride, 2-(4-Methylpiperazin-1-yl)-1-phenylethyl 2-ethoxybenzoate--hydrogen chloride (1/2), [2-(4-methylpiperazin-1-yl)-1-phenylethyl] 2-ethoxybenzoate dihydrochloride
Technical Specifications
| Molecular Formula | C22H30Cl2N2O3 |
| Molecular Weight | 440.16336 g/mol |
| XLogP | 4.0744 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 440.16336 Da |
| Heavy Atoms | 29 |
| Complexity | 445.0 |
| SMILES | CCOC1=CC=CC=C1C(=O)OC(CN2CCN(CC2)C)C3=CC=CC=C3.Cl.Cl |
| InChIKey | XRLOOLCRLDTBMC-UHFFFAOYSA-N |
Chemical Property Profile of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride
Property Insights of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride
The XLogP value of 4.0744 indicates that 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.0 Ų, 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) 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
What is the CAS number of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride?
The CAS number of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride is 114000-42-9.
What is the molecular formula of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride?
The molecular formula of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride is C22H30Cl2N2O3.
What is the molecular weight of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride?
The molecular weight of 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride is 440.16336 g/mol.
Where can I buy 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride?
You can request a quote for 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride?
Yes, CoreyChem provides custom synthesis services for 4-Methyl-alpha-phenyl-1-piperazineethanol o-ethoxybenzoate (ester) dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.