4-Methylthiopyrimidine
TL;DR: 4-Methylthiopyrimidine (CAS 6104-46-7) is a chemical compound with molecular formula C5H6N2S and molecular weight 126.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanylpyrimidine
Also Known As: 4-methylthiopyrimidine, 4-(Methylthio)pyrimidine, 4-methylsulfanylpyrimidine, pyrimidine, 4-methylthio-, Methyl 4-pyrimidinyl sulfide
| Molecular Formula | C5H6N2S |
|---|---|
| Molecular Weight | 126.03 g/mol |
| LogP | 1.1985 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.02517 |
| Heavy Atoms | 8 |
| Complexity | 151.77466 |
Chemical Identifiers
| CAS Number | 6104-46-7 |
|---|---|
| SMILES | CSC1=NC=NC=C1 |
Product Overview
4-Methylthiopyrimidine (CAS 6104-46-7), with molecular formula C5H6N2S and molecular weight 126.03 g/mol. IUPAC: 4-methylsulfanylpyrimidine.
Chemical Property Profile of 4-Methylthiopyrimidine
Property Insights of 4-Methylthiopyrimidine
The XLogP value of 1.1985 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylthiopyrimidine. With a topological polar surface area (TPSA) of 25.78 Ų, 4-Methylthiopyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylthiopyrimidine has 0 hydrogen bond donor(s) and 3 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-Methylthiopyrimidine?
The CAS number of 4-Methylthiopyrimidine is 6104-46-7.
What is the molecular formula of 4-Methylthiopyrimidine?
The molecular formula of 4-Methylthiopyrimidine is C5H6N2S.
What is the molecular weight of 4-Methylthiopyrimidine?
The molecular weight of 4-Methylthiopyrimidine is 126.03 g/mol.
Where can I buy 4-Methylthiopyrimidine?
You can request a quote for 4-Methylthiopyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylthiopyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylthiopyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.