2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one
TL;DR: 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one (CAS 7249-71-0) is a chemical compound with molecular formula C4H4N2OS2 and molecular weight 159.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(sulfanylidene)-1,3-diazinan-4-one
Also Known As: dithiobarbituric acid, 2,6-bis(sulfanylidene)-1,3-diazinan-4-one, 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one, RefChem:248060
| Molecular Formula | C4H4N2OS2 |
|---|---|
| Molecular Weight | 159.98 g/mol |
| LogP | -0.2918 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 159.9765 |
| Heavy Atoms | 9 |
| Complexity | 143.72244 |
Chemical Identifiers
| CAS Number | 7249-71-0 |
|---|---|
| SMILES | C1C(=O)NC(=S)NC1=S |
Product Overview
2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one (CAS 7249-71-0), with molecular formula C4H4N2OS2 and molecular weight 159.98 g/mol. IUPAC: 2,6-bis(sulfanylidene)-1,3-diazinan-4-one.
Chemical Property Profile of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one
Property Insights of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one
The XLogP value of -0.2918 indicates that 2,6-Bis(sulfanylidene)tetrahydropyrimidin-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, 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one has 2 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 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one?
The CAS number of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one is 7249-71-0.
What is the molecular formula of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one?
The molecular formula of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one is C4H4N2OS2.
What is the molecular weight of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one?
The molecular weight of 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one is 159.98 g/mol.
Where can I buy 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one?
You can request a quote for 2,6-Bis(sulfanylidene)tetrahydropyrimidin-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 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Bis(sulfanylidene)tetrahydropyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.