![2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol structure](/static/products/893/893769-29-4.png)
2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol
TL;DR: 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol (CAS 893769-29-4) is a chemical compound with molecular formula C17H14FN3O and molecular weight 295.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(E)-2-(4-fluorophenyl)ethenyl]-2-methyl-1,2,4-triazol-3-yl]phenol
Also Known As: A4107/0175141, (E)-2-(3-(4-fluorostyryl)-1-methyl-1H-1,2,4-triazol-5-yl)phenol, 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol, 2-{3-[(1E)-2-(4-FLUOROPHENYL)ETHENYL]-1-METHYL-1H-1,2,4-TRIAZOL-5-YL}PHENOL, 2-{3-[(E)-2-(4-fluorophenyl)ethenyl]-1-methyl-1H-1,2,4-triazol-5-yl}phenol
| Molecular Formula | C17H14FN3O |
|---|---|
| Molecular Weight | 295.11 g/mol |
| LogP | 3.4972 |
| Topological Polar Surface Area | 50.94 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.1121 |
| Heavy Atoms | 22 |
| Complexity | 822.17535 |
Chemical Identifiers
| CAS Number | 893769-29-4 |
|---|---|
| SMILES | CN1C(=NC(=N1)/C=C/C2=CC=C(C=C2)F)C3=CC=CC=C3O |
Product Overview
2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol (CAS 893769-29-4), with molecular formula C17H14FN3O and molecular weight 295.11 g/mol. IUPAC: 2-[5-[(E)-2-(4-fluorophenyl)ethenyl]-2-methyl-1,2,4-triazol-3-yl]phenol.
Chemical Property Profile of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol
Property Insights of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol
The XLogP value of 3.4972 indicates that 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.94 Ų, 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol has 1 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-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol?
The CAS number of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol is 893769-29-4.
What is the molecular formula of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol?
The molecular formula of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol is C17H14FN3O.
What is the molecular weight of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol?
The molecular weight of 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol is 295.11 g/mol.
Where can I buy 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol?
You can request a quote for 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-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-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-{3-[(1E)-2-(4-fluorophenyl)vinyl]-1-methyl-1,2,4-triazol-5-yl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.