1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride
TL;DR: 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride (CAS 1052527-92-0) is a chemical compound with molecular formula C18H29ClN2O5 and molecular weight 388.1765 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate;hydrochloride
Also Known As: 1-(4-methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride, 3,4,5-Trimethoxy-benzoic acid 1-methyl-2-(4-methyl-piperazin-1-yl)-ethyl ester
Technical Specifications
| Molecular Formula | C18H29ClN2O5 |
| Molecular Weight | 388.1765 g/mol |
| XLogP | 1.9269 |
| Topological Polar Surface Area (TPSA) | 60.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 388.1765 Da |
| Heavy Atoms | 26 |
| Complexity | 400.0 |
| SMILES | CC(CN1CCN(CC1)C)OC(=O)C2=CC(=C(C(=C2)OC)OC)OC.Cl |
| InChIKey | YYTHFGUDZRHTDR-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride
Property Insights of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride
The XLogP value of 1.9269 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride. The TPSA of 60.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride. Following Lipinski's Rule of Five, 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride?
The CAS number of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride is 1052527-92-0.
What is the molecular formula of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride?
The molecular formula of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride is C18H29ClN2O5.
What is the molecular weight of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride?
The molecular weight of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride is 388.1765 g/mol.
Where can I buy 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride?
You can request a quote for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride?
Yes, CoreyChem provides custom synthesis services for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4,5-trimethoxybenzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.