![2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol structure](/static/products/577/577694-21-4.png)
2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol
TL;DR: 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol (CAS 577694-21-4) is a chemical compound with molecular formula C19H16N4O and molecular weight 316.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-[(E)-2-(1-methylindol-3-yl)ethenyl]-1H-1,2,4-triazol-3-yl]phenol
Also Known As: BAS 06265327, A3461/0146858, 2-{3-[2-(1-methyl-1H-indol-3-yl)vinyl]-1H-1,2,4-triazol-5-yl}phenol, (E)-2-(3-(2-(1-methyl-1H-indol-3-yl)vinyl)-1H-1,2,4-triazol-5-yl)phenol, 2-{3-[(E)-2-(1-METHYL-1H-INDOL-3-YL)-1-ETHENYL]-1H-1,2,4-TRIAZOL-5-YL}PHENOL
| Molecular Formula | C19H16N4O |
|---|---|
| Molecular Weight | 316.13 g/mol |
| LogP | 3.8394 |
| Topological Polar Surface Area | 66.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 316.13242 |
| Heavy Atoms | 24 |
| Complexity | 1042.4003 |
Chemical Identifiers
| CAS Number | 577694-21-4 |
|---|---|
| SMILES | CN1C=C(C2=CC=CC=C21)/C=C/C3=NC(=NN3)C4=CC=CC=C4O |
Product Overview
2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol (CAS 577694-21-4), with molecular formula C19H16N4O and molecular weight 316.13 g/mol. IUPAC: 2-[5-[(E)-2-(1-methylindol-3-yl)ethenyl]-1H-1,2,4-triazol-3-yl]phenol.
Chemical Property Profile of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol
Property Insights of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol
The XLogP value of 3.8394 indicates that 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol. Following Lipinski's Rule of Five, 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-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-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol?
The CAS number of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol is 577694-21-4.
What is the molecular formula of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol?
The molecular formula of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol is C19H16N4O.
What is the molecular weight of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol?
The molecular weight of 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol is 316.13 g/mol.
Where can I buy 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol?
You can request a quote for 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-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-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-{3-[(E)-2-(1-methyl-1H-indol-3-yl)ethenyl]-1H-1,2,4-triazol-5-yl}phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.