2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester
TL;DR: 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester (CAS 918524-63-7) is a chemical compound with molecular formula C16H26BN3O2 and molecular weight 303.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine
Also Known As: 1-Methyl-4-(5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine, 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester, 1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine, 2-(4-methyl-piperazin-1-yl)pyridine-5-boronic acid pinacol ester, 2-(4-METHYLPIPERAZINO)PYRIDINE-5-BORONIC ACID PINACOL ESTER
| Molecular Formula | C16H26BN3O2 |
|---|---|
| Molecular Weight | 303.21 g/mol |
| LogP | 1.1326 |
| Topological Polar Surface Area | 37.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 303.2118 |
| Heavy Atoms | 22 |
| Complexity | 508.6974 |
Chemical Identifiers
| CAS Number | 918524-63-7 |
|---|---|
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)N3CCN(CC3)C |
Product Overview
2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester (CAS 918524-63-7), with molecular formula C16H26BN3O2 and molecular weight 303.21 g/mol. IUPAC: 1-methyl-4-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]piperazine.
Chemical Property Profile of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester
Property Insights of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester
The XLogP value of 1.1326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester. With a topological polar surface area (TPSA) of 37.83 Ų, 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester has 0 hydrogen bond donor(s) and 5 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-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester?
The CAS number of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester is 918524-63-7.
What is the molecular formula of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester?
The molecular formula of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester is C16H26BN3O2.
What is the molecular weight of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester?
The molecular weight of 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester is 303.21 g/mol.
Where can I buy 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester?
You can request a quote for 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-methylpiperazin-1-yl)pyridine-5-boronic acid pinacol ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.