6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one
TL;DR: 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one (CAS 6300-93-2) is a chemical compound with molecular formula C5H8N2OS and molecular weight 144.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-sulfanylidene-1,3-diazinan-4-one
Also Known As: 6-Methyl-2-thiouracil, 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one, 6-methyl-2-sulfanylidene-1,3-diazinan-4-one, 6-methyl-2-thioxo-tetrahydro-pyrimidin-4-one, 6-methyl-2-sulfanyl-5,6-dihydropyrimidin-4(3H)-one
| Molecular Formula | C5H8N2OS |
|---|---|
| Molecular Weight | 144.04 g/mol |
| LogP | -0.2307 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 144.03574 |
| Heavy Atoms | 9 |
| Complexity | 141.03699 |
Chemical Identifiers
| CAS Number | 6300-93-2 |
|---|---|
| SMILES | CC1CC(=O)NC(=S)N1 |
Product Overview
6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one (CAS 6300-93-2), with molecular formula C5H8N2OS and molecular weight 144.04 g/mol. IUPAC: 6-methyl-2-sulfanylidene-1,3-diazinan-4-one.
Chemical Property Profile of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one
Property Insights of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one
The XLogP value of -0.2307 indicates that 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 41.13 Ų, 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one has 2 hydrogen bond donor(s) and 2 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 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one?
The CAS number of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one is 6300-93-2.
What is the molecular formula of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one?
The molecular formula of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one is C5H8N2OS.
What is the molecular weight of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one?
The molecular weight of 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one is 144.04 g/mol.
Where can I buy 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one?
You can request a quote for 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-methyl-2-thioxotetrahydropyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.