2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-
TL;DR: 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- (CAS 110815-43-5) is a chemical compound with molecular formula C5H5ClN2O3 and molecular weight 175.99887 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-chloro-5-methyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-chloro-6-methylbarbituric acid, 5-chloro-5-methyl-1,3-diazinane-2,4,6-trione, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-
Technical Specifications
| Molecular Formula | C5H5ClN2O3 |
| Molecular Weight | 175.99887 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.99887 Da |
| Heavy Atoms | 11 |
| Complexity | 230.0 |
| SMILES | CC1(C(=O)NC(=O)NC1=O)Cl |
| InChIKey | XYKPWCSWSYGMBN-UHFFFAOYSA-N |
Chemical Property Profile of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-
Property Insights of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-
The XLogP value of -0.5 indicates that 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-. Following Lipinski's Rule of Five, 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-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
What is the CAS number of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-?
The CAS number of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- is 110815-43-5.
What is the molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-?
The molecular formula of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- is C5H5ClN2O3.
What is the molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-?
The molecular weight of 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- is 175.99887 g/mol.
Where can I buy 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-?
You can request a quote for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl-?
Yes, CoreyChem provides custom synthesis services for 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-chloro-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.