5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione
TL;DR: 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione (CAS 1681-77-2) is a chemical compound with molecular formula C5H7BrN2O2 and molecular weight 205.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-5-methyl-1,3-diazinane-2,4-dione
Also Known As: 5-Brom-dihydrothymin, 5-Bromodihydro-5-methyluracil, 5-bromo-5,6-dihydrothymine, 5-bromo-5-methyl-1,3-diazinane-2,4-dione, 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione
| Molecular Formula | C5H7BrN2O2 |
|---|---|
| Molecular Weight | 205.97 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.96909 |
| Heavy Atoms | 10 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 1681-77-2 |
|---|---|
| SMILES | CC1(CNC(=O)NC1=O)Br |
| InChIKey | JAYJINMXBQPKAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione (CAS 1681-77-2), with molecular formula C5H7BrN2O2 and molecular weight 205.97 g/mol. IUPAC: 5-bromo-5-methyl-1,3-diazinane-2,4-dione.
Chemical Property Profile of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione
Property Insights of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione
The XLogP value of -0.1 indicates that 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-5-methyldihydropyrimidine-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
Frequently Asked Questions
What is the CAS number of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione?
The CAS number of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione is 1681-77-2.
What is the molecular formula of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione?
The molecular formula of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione is C5H7BrN2O2.
What is the molecular weight of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione?
The molecular weight of 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione is 205.97 g/mol.
Where can I buy 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione?
You can request a quote for 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-5-methyldihydropyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.