5-Methyl-4-(methylthio)pyrimidin-2-ol
TL;DR: 5-Methyl-4-(methylthio)pyrimidin-2-ol (CAS 55040-79-4) is a chemical compound with molecular formula C6H8N2OS and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-6-methylsulfanyl-1H-pyrimidin-2-one
Also Known As: 5-methyl-4-(methylthio)pyrimidin-2-ol, 4-methylthiothymine, 5-methyl-6-methylsulfanyl-1H-pyrimidin-2-one, 2-pyrimidinol, 5-methyl-4-(methylthio)-, 5-methyl-4-(methylthio)pyrimidin-2(1H)-one
| Molecular Formula | C6H8N2OS |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | 0.80022 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.03574 |
| Heavy Atoms | 10 |
| Complexity | 281.32147 |
Chemical Identifiers
| CAS Number | 55040-79-4 |
|---|---|
| SMILES | CC1=C(NC(=O)N=C1)SC |
Product Overview
5-Methyl-4-(methylthio)pyrimidin-2-ol (CAS 55040-79-4), with molecular formula C6H8N2OS and molecular weight 156.04 g/mol. IUPAC: 5-methyl-6-methylsulfanyl-1H-pyrimidin-2-one.
Chemical Property Profile of 5-Methyl-4-(methylthio)pyrimidin-2-ol
Property Insights of 5-Methyl-4-(methylthio)pyrimidin-2-ol
The XLogP value of 0.80022 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methyl-4-(methylthio)pyrimidin-2-ol. With a topological polar surface area (TPSA) of 45.75 Ų, 5-Methyl-4-(methylthio)pyrimidin-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-4-(methylthio)pyrimidin-2-ol has 1 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 5-Methyl-4-(methylthio)pyrimidin-2-ol?
The CAS number of 5-Methyl-4-(methylthio)pyrimidin-2-ol is 55040-79-4.
What is the molecular formula of 5-Methyl-4-(methylthio)pyrimidin-2-ol?
The molecular formula of 5-Methyl-4-(methylthio)pyrimidin-2-ol is C6H8N2OS.
What is the molecular weight of 5-Methyl-4-(methylthio)pyrimidin-2-ol?
The molecular weight of 5-Methyl-4-(methylthio)pyrimidin-2-ol is 156.04 g/mol.
Where can I buy 5-Methyl-4-(methylthio)pyrimidin-2-ol?
You can request a quote for 5-Methyl-4-(methylthio)pyrimidin-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-4-(methylthio)pyrimidin-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-4-(methylthio)pyrimidin-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.