![2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol structure](/static/products/733/733798-18-0.png)
2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol
TL;DR: 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol (CAS 733798-18-0) is a chemical compound with molecular formula C9H8Br2N4O and molecular weight 345.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dibromo-6-[(1,2,4-triazol-4-ylamino)methyl]phenol
Also Known As: 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol, 2,4-dibromo-6-[(1,2,4-triazol-4-ylamino)methyl]phenol, A3950/0168271, Phenol, 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]-
| Molecular Formula | C9H8Br2N4O |
|---|---|
| Molecular Weight | 345.91 g/mol |
| LogP | 2.2524 |
| Topological Polar Surface Area | 62.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 345.9065 |
| Heavy Atoms | 16 |
| Complexity | 486.50424 |
Chemical Identifiers
| CAS Number | 733798-18-0 |
|---|---|
| SMILES | C1=C(C=C(C(=C1CNN2C=NN=C2)O)Br)Br |
Product Overview
2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol (CAS 733798-18-0), with molecular formula C9H8Br2N4O and molecular weight 345.91 g/mol. IUPAC: 2,4-dibromo-6-[(1,2,4-triazol-4-ylamino)methyl]phenol.
Chemical Property Profile of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol
Property Insights of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol
The XLogP value of 2.2524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol. The TPSA of 62.97 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol. Following Lipinski's Rule of Five, 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol has 2 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 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol?
The CAS number of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol is 733798-18-0.
What is the molecular formula of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol?
The molecular formula of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol is C9H8Br2N4O.
What is the molecular weight of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol?
The molecular weight of 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol is 345.91 g/mol.
Where can I buy 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol?
You can request a quote for 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]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-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dibromo-6-[(4H-1,2,4-triazol-4-ylamino)methyl]phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.