6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione
TL;DR: 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione (CAS 134701-20-5) is a chemical compound with molecular formula C11H9BrN2O2 and molecular weight 279.98474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-benzyl-5-bromo-1H-pyrimidine-2,4-dione
Also Known As: 6-benzyl-5-bromopyrimidine-2,4(1h,3h)-dione, NCIOpen2_007058, 6-benzyl-5-bromo-1H-pyrimidine-2,4-dione, 2,4(1H,3H)-Pyrimidinedione, 5-bromo-6-(phenylmethyl)-, J2.808.330K
Technical Specifications
| Molecular Formula | C11H9BrN2O2 |
| Molecular Weight | 279.98474 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.98474 Da |
| Heavy Atoms | 16 |
| Complexity | 346.0 |
| SMILES | C1=CC=C(C=C1)CC2=C(C(=O)NC(=O)N2)Br |
| InChIKey | SBFBXAVNDQFOFH-UHFFFAOYSA-N |
Chemical Property Profile of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione
Property Insights of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione. With a topological polar surface area (TPSA) of 58.2 Ų, 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione 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
What is the CAS number of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione?
The CAS number of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione is 134701-20-5.
What is the molecular formula of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione?
The molecular formula of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione is C11H9BrN2O2.
What is the molecular weight of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione?
The molecular weight of 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione is 279.98474 g/mol.
Where can I buy 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione?
You can request a quote for 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione?
Yes, CoreyChem provides custom synthesis services for 6-Benzyl-5-bromopyrimidine-2,4(1h,3h)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.