2,4-dibromo-5-(2H-triazol-4-yl)phenol
TL;DR: 2,4-dibromo-5-(2H-triazol-4-yl)phenol (CAS 369363-93-9) is a chemical compound with molecular formula C8H5Br2N3O and molecular weight 316.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dibromo-5-(2H-triazol-4-yl)phenol
Also Known As: 2,4-dibromo-5-(2H-triazol-4-yl)phenol, 2,4-dibromo-5-(1H-1,2,3-triazol-5-yl)Phenol
| Molecular Formula | C8H5Br2N3O |
|---|---|
| Molecular Weight | 316.88 g/mol |
| LogP | 2.7023 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.87994 |
| Heavy Atoms | 14 |
| Complexity | 455.86 |
Chemical Identifiers
| CAS Number | 369363-93-9 |
|---|---|
| SMILES | C1=C(C(=CC(=C1O)Br)Br)C2=NNN=C2 |
Product Overview
2,4-dibromo-5-(2H-triazol-4-yl)phenol (CAS 369363-93-9), with molecular formula C8H5Br2N3O and molecular weight 316.88 g/mol. IUPAC: 2,4-dibromo-5-(2H-triazol-4-yl)phenol.
Chemical Property Profile of 2,4-dibromo-5-(2H-triazol-4-yl)phenol
Property Insights of 2,4-dibromo-5-(2H-triazol-4-yl)phenol
The XLogP value of 2.7023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-dibromo-5-(2H-triazol-4-yl)phenol. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dibromo-5-(2H-triazol-4-yl)phenol. Following Lipinski's Rule of Five, 2,4-dibromo-5-(2H-triazol-4-yl)phenol has 2 hydrogen bond donor(s) and 3 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 2,4-dibromo-5-(2H-triazol-4-yl)phenol?
The CAS number of 2,4-dibromo-5-(2H-triazol-4-yl)phenol is 369363-93-9.
What is the molecular formula of 2,4-dibromo-5-(2H-triazol-4-yl)phenol?
The molecular formula of 2,4-dibromo-5-(2H-triazol-4-yl)phenol is C8H5Br2N3O.
What is the molecular weight of 2,4-dibromo-5-(2H-triazol-4-yl)phenol?
The molecular weight of 2,4-dibromo-5-(2H-triazol-4-yl)phenol is 316.88 g/mol.
Where can I buy 2,4-dibromo-5-(2H-triazol-4-yl)phenol?
You can request a quote for 2,4-dibromo-5-(2H-triazol-4-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dibromo-5-(2H-triazol-4-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dibromo-5-(2H-triazol-4-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.