1-Methyl-5-bromouracil
TL;DR: 1-Methyl-5-bromouracil (CAS 6327-97-5) is a chemical compound with molecular formula C5H5BrN2O2 and molecular weight 203.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-methylpyrimidine-2,4-dione
Also Known As: 1-Methyl-5-bromouracil, 5-bromo-1-methylpyrimidine-2,4(1h,3h)-dione, 5-Bromo-1-methyluracil, Uracil, 5-bromo-1-methyl-, 5-bromo-1-methylpyrimidine-2,4-dione
| Molecular Formula | C5H5BrN2O2 |
|---|---|
| Molecular Weight | 203.95 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 203.95345 |
| Heavy Atoms | 10 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 6327-97-5 |
|---|---|
| SMILES | CN1C=C(C(=O)NC1=O)Br |
| InChIKey | PIVKLKRNXWUHSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-5-bromouracil (CAS 6327-97-5), with molecular formula C5H5BrN2O2 and molecular weight 203.95 g/mol. IUPAC: 5-bromo-1-methylpyrimidine-2,4-dione.
Chemical Property Profile of 1-Methyl-5-bromouracil
Property Insights of 1-Methyl-5-bromouracil
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-5-bromouracil. With a topological polar surface area (TPSA) of 49.4 Ų, 1-Methyl-5-bromouracil exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-5-bromouracil has 1 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 1-Methyl-5-bromouracil?
The CAS number of 1-Methyl-5-bromouracil is 6327-97-5.
What is the molecular formula of 1-Methyl-5-bromouracil?
The molecular formula of 1-Methyl-5-bromouracil is C5H5BrN2O2.
What is the molecular weight of 1-Methyl-5-bromouracil?
The molecular weight of 1-Methyl-5-bromouracil is 203.95 g/mol.
Where can I buy 1-Methyl-5-bromouracil?
You can request a quote for 1-Methyl-5-bromouracil directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-5-bromouracil?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-5-bromouracil and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.