2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine
TL;DR: 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine (CAS 124959-46-2) is a chemical compound with molecular formula C17H18N4S2 and molecular weight 342.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine
Also Known As: 2-(4-MePip)-4,6-diThienyl-Pyr, 2-(4-methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine, 2-(4-Methylpiperazin)-4,6-di-2-thienyl-pyrimidine, 1-[4,6-Bis(2-thienyl)pyrimidin-2-yl]-4-methylpiperazine, 2-(4-methylpiperazin-1-yl)-4,6-bis(2-thienyl)pyrimidine
| Molecular Formula | C17H18N4S2 |
|---|---|
| Molecular Weight | 342.10 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 88.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 342.0973 |
| Heavy Atoms | 23 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 124959-46-2 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC(=CC(=N2)C3=CC=CS3)C4=CC=CS4 |
| InChIKey | SMHGSXDLJAVPBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine (CAS 124959-46-2), with molecular formula C17H18N4S2 and molecular weight 342.10 g/mol. IUPAC: 2-(4-methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine.
Chemical Property Profile of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine
Property Insights of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine
The XLogP value of 3.2 indicates that 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine. Following Lipinski's Rule of Five, 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine has 0 hydrogen bond donor(s) and 6 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)-4,6-dithiophen-2-ylpyrimidine?
The CAS number of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine is 124959-46-2.
What is the molecular formula of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine?
The molecular formula of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine is C17H18N4S2.
What is the molecular weight of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine?
The molecular weight of 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine is 342.10 g/mol.
Where can I buy 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine?
You can request a quote for 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine 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)-4,6-dithiophen-2-ylpyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methylpiperazin-1-yl)-4,6-dithiophen-2-ylpyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.