5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine
TL;DR: 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine (CAS 79091-24-0) is a chemical compound with molecular formula C5H4BrClN2O2S and molecular weight 269.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-4-chloro-2-methylsulfonylpyrimidine
Also Known As: 5-BROMO-4-CHLORO-2-(METHYLSULFONYL)PYRIMIDINE, 5-Bromo-4-chloro-2-methylsulfonylpyrimidine, 5-BROMO-4-CHLORO-2-METHANESULFONYL-PYRIMIDINE, 5-BROMO-4-CHLORO-2-METHANESULFONYLPYRIMIDINE, 5-Bromo-4-chloro-2-methylsulphonylpyrimidine
| Molecular Formula | C5H4BrClN2O2S |
|---|---|
| Molecular Weight | 269.89 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 68.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 269.88654 |
| Heavy Atoms | 12 |
| Complexity | 253.0 |
Chemical Identifiers
| CAS Number | 79091-24-0 |
|---|---|
| SMILES | CS(=O)(=O)C1=NC=C(C(=N1)Cl)Br |
| InChIKey | FATRNESSGITUQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine (CAS 79091-24-0), with molecular formula C5H4BrClN2O2S and molecular weight 269.89 g/mol. IUPAC: 5-bromo-4-chloro-2-methylsulfonylpyrimidine.
Chemical Property Profile of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine
Property Insights of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine. The TPSA of 68.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine. Following Lipinski's Rule of Five, 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine has 0 hydrogen bond donor(s) and 4 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-4-chloro-2-(methylsulfonyl)pyrimidine?
The CAS number of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine is 79091-24-0.
What is the molecular formula of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine?
The molecular formula of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine is C5H4BrClN2O2S.
What is the molecular weight of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine?
The molecular weight of 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine is 269.89 g/mol.
Where can I buy 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine?
You can request a quote for 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-4-chloro-2-(methylsulfonyl)pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.