5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione
TL;DR: 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione (CAS 15018-59-4) is a chemical compound with molecular formula C7H9BrN2O2 and molecular weight 231.98474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-1,3,6-trimethylpyrimidine-2,4-dione
Also Known As: 5-Bromo-1,3,6-trimethyluracil, 5-Bromo-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione, 5-bromo-1,3,6-trimethylpyrimidine-2,4-dione, Uracil, 5-bromo-1,3,6-trimethyl-, 2,4(1H,3H)-Pyrimidinedione, 5-bromo-1,3,6-trimethyl-
Technical Specifications
| Molecular Formula | C7H9BrN2O2 |
| Molecular Weight | 231.98474 g/mol |
| XLogP | -0.2 |
| Topological Polar Surface Area (TPSA) | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 231.98474 Da |
| Heavy Atoms | 12 |
| Complexity | 285.0 |
| SMILES | CC1=C(C(=O)N(C(=O)N1C)C)Br |
| InChIKey | RJNYZLOAGXCCHJ-UHFFFAOYSA-N |
Chemical Property Profile of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione
Property Insights of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione
The XLogP value of -0.2 indicates that 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.6 Ų, 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione?
The CAS number of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione is 15018-59-4.
What is the molecular formula of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione?
The molecular formula of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione is C7H9BrN2O2.
What is the molecular weight of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione?
The molecular weight of 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione is 231.98474 g/mol.
Where can I buy 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione?
You can request a quote for 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione?
Yes, CoreyChem provides custom synthesis services for 5-Bromo-1,3,6-trimethyl-2,4(1H,3H)-pyrimidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.