![2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- structure](/static/products/5964/59640-46-9.webp)
2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-
TL;DR: 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- (CAS 59640-46-9) is a chemical compound with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(methylsulfanylmethyl)-1H-pyrimidine-2,4-dione
Also Known As: 6-Methylthiomethyluracil, 6-[ methyl]uracil, 6-((Methylthio)methyl)uracil, 6-[(Methylthio)methyl ]uracil, 2,4(1h,3h)-pyrimidinedione, 6-[(methylthio)methyl]-
| Molecular Formula | C6H8N2O2S |
|---|---|
| Molecular Weight | 172.03 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.03065 |
| Heavy Atoms | 11 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 59640-46-9 |
|---|---|
| SMILES | CSCC1=CC(=O)NC(=O)N1 |
| InChIKey | UFFDUWYBBNRDNJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- (CAS 59640-46-9), with molecular formula C6H8N2O2S and molecular weight 172.03 g/mol. IUPAC: 6-(methylsulfanylmethyl)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-
Property Insights of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-
The XLogP value of -0.7 indicates that 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-. Following Lipinski's Rule of Five, 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- 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 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-?
The CAS number of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- is 59640-46-9.
What is the molecular formula of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-?
The molecular formula of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- is C6H8N2O2S.
What is the molecular weight of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-?
The molecular weight of 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- is 172.03 g/mol.
Where can I buy 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-?
You can request a quote for 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]-?
Yes, KEHONG BIO provides custom synthesis services for 2,4(1H,3H)-Pyrimidinedione, 6-[(methylthio)methyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.