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1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride structure
Fine Chemical

1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride

TL;DR: 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride (CAS 1052536-37-4) is a chemical compound with molecular formula C17H27ClN2O4 and molecular weight 358.16592 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-dimethoxybenzoate;hydrochloride

Also Known As: 1-(4-methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride

CAS Number
1052536-37-4
Molecular Formula
C17H27ClN2O4
Molecular Weight
358.16592 g/mol
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Technical Specifications

Molecular FormulaC17H27ClN2O4
Molecular Weight358.16592 g/mol
XLogP1.9183
Topological Polar Surface Area (TPSA)51.2 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors7
Rotatable Bonds7
Exact Mass358.16592 Da
Heavy Atoms24
Complexity372.0
SMILESCC(CN1CCN(CC1)C)OC(=O)C2=CC(=C(C=C2)OC)OC.Cl
InChIKeySIOVCTQKTSLGPZ-UHFFFAOYSA-N

Chemical Property Profile of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride

XLogP
1.9183
TPSA (Topological Polar Surface Area)
51.2
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
7
Heavy Atoms
24
Complexity
372.0
Exact Mass
358.16592
Monoisotopic Mass
358.16592
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride

The XLogP value of 1.9183 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride. With a topological polar surface area (TPSA) of 51.2 Ų, 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride has 1 hydrogen bond donor(s) and 7 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-dimethoxybenzoate hydrochloride?

The CAS number of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride is 1052536-37-4.

What is the molecular formula of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride?

The molecular formula of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride is C17H27ClN2O4.

What is the molecular weight of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride?

The molecular weight of 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride is 358.16592 g/mol.

Where can I buy 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride?

You can request a quote for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate 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-dimethoxybenzoate hydrochloride?

Yes, CoreyChem provides custom synthesis services for 1-(4-Methylpiperazin-1-yl)propan-2-yl 3,4-dimethoxybenzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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