Bromopyrine
TL;DR: Bromopyrine (CAS 603-65-6) is a chemical compound with molecular formula C11H11BrN2O and molecular weight 266.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-bromophenyl)-1,5-dimethylpyrazol-3-one
Also Known As: BROMOPYRINE, 2-(4-bromophenyl)-1,5-dimethylpyrazol-3-one, 1,2-Dihydro-2- -1,5-dimethyl-3H-pyrazol-3-one, 3-Pyrazolin-5-one, 1-(p-bromophenyl)-2,3-dimethyl-, 2-(4-Brom-phenyl)-1,5-dimethyl-1,2-dihydro-pyrazol-3-on
| Molecular Formula | C11H11BrN2O |
|---|---|
| Molecular Weight | 266.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.0055 |
| Heavy Atoms | 15 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 603-65-6 |
|---|---|
| SMILES | CC1=CC(=O)N(N1C)C2=CC=C(C=C2)Br |
| InChIKey | RYPXUXARNBYXCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bromopyrine (CAS 603-65-6), with molecular formula C11H11BrN2O and molecular weight 266.01 g/mol. IUPAC: 2-(4-bromophenyl)-1,5-dimethylpyrazol-3-one.
Chemical Property Profile of Bromopyrine
Property Insights of Bromopyrine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bromopyrine. With a topological polar surface area (TPSA) of 23.6 Ų, Bromopyrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bromopyrine 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
Frequently Asked Questions
What is the CAS number of Bromopyrine?
The CAS number of Bromopyrine is 603-65-6.
What is the molecular formula of Bromopyrine?
The molecular formula of Bromopyrine is C11H11BrN2O.
What is the molecular weight of Bromopyrine?
The molecular weight of Bromopyrine is 266.01 g/mol.
Where can I buy Bromopyrine?
You can request a quote for Bromopyrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromopyrine?
Yes, KEHONG BIO provides custom synthesis services for Bromopyrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.