Tebrofen
TL;DR: Tebrofen (CAS 33614-84-5) is a chemical compound with molecular formula C12H6Br4O4 and molecular weight 529.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dibromo-6-(3,5-dibromo-2,4-dihydroxyphenyl)benzene-1,3-diol
Also Known As: Tebrofen, Tebrophene, 3,3',5,5'-tetrabromobiphenyl-2,2',4,4'-tetrol, Bi(3,5-dibromo-2,4-dihydroxyphenyl), [1,1'-biphenyl]-2,2',4,4'-tetrol, 3,3',5,5'-tetrabromo-
| Molecular Formula | C12H6Br4O4 |
|---|---|
| Molecular Weight | 529.70 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 529.69995 |
| Heavy Atoms | 20 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 33614-84-5 |
|---|---|
| SMILES | C1=C(C(=C(C(=C1Br)O)Br)O)C2=CC(=C(C(=C2O)Br)O)Br |
| InChIKey | OCOSYMCDPNAWPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tebrofen (CAS 33614-84-5), with molecular formula C12H6Br4O4 and molecular weight 529.70 g/mol. IUPAC: 2,4-dibromo-6-(3,5-dibromo-2,4-dihydroxyphenyl)benzene-1,3-diol.
Chemical Property Profile of Tebrofen
Property Insights of Tebrofen
The XLogP value of 4.9 indicates that Tebrofen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Tebrofen. Following Lipinski's Rule of Five, Tebrofen has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tebrofen?
The CAS number of Tebrofen is 33614-84-5.
What is the molecular formula of Tebrofen?
The molecular formula of Tebrofen is C12H6Br4O4.
What is the molecular weight of Tebrofen?
The molecular weight of Tebrofen is 529.70 g/mol.
Where can I buy Tebrofen?
You can request a quote for Tebrofen directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tebrofen?
Yes, KEHONG BIO provides custom synthesis services for Tebrofen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.