4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine
TL;DR: 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine (CAS 63731-95-3) is a chemical compound with molecular formula C15H25ClN6S and molecular weight 356.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2,6-bis(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidine
Also Known As: 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine, 4-chloro-2,6-bis(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidine, 4-chloro-2,6-bis(4-methylpiperazin-1-yl)-5-(methylsulfanyl)pyrimidine, 4-chloro-2,6-bis(4-methylpiperazin-1-yl)-5-methylsulfanyl-pyrimidine, Pyrimidine, 4-chloro-2,6-bis(4-methyl-1-piperazinyl)-5-(methylthio)-
| Molecular Formula | C15H25ClN6S |
|---|---|
| Molecular Weight | 356.15 g/mol |
| LogP | 1.3555 |
| Topological Polar Surface Area | 38.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.155 |
| Heavy Atoms | 23 |
| Complexity | 541.0138 |
Chemical Identifiers
| CAS Number | 63731-95-3 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C(=NC(=N2)N3CCN(CC3)C)Cl)SC |
Product Overview
4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine (CAS 63731-95-3), with molecular formula C15H25ClN6S and molecular weight 356.15 g/mol. IUPAC: 4-chloro-2,6-bis(4-methylpiperazin-1-yl)-5-methylsulfanylpyrimidine.
Chemical Property Profile of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine
Property Insights of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine
The XLogP value of 1.3555 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine. With a topological polar surface area (TPSA) of 38.74 Ų, 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine has 0 hydrogen bond donor(s) and 7 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 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine?
The CAS number of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine is 63731-95-3.
What is the molecular formula of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine?
The molecular formula of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine is C15H25ClN6S.
What is the molecular weight of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine?
The molecular weight of 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine is 356.15 g/mol.
Where can I buy 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine?
You can request a quote for 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2,6-bis(4-methylpiperazino)-5-(methylthio)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.