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4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol structure
Fine Chemical

4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol

TL;DR: 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol (CAS 1009033-96-8) is a chemical compound with molecular formula C14H12N4O2 and molecular weight 268.09604 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[4-amino-5-(4-hydroxyphenyl)-1,2,4-triazol-3-yl]phenol

Also Known As: 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol, 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]phenol, 4-[4-amino-5-(4-hydroxyphenyl)-1,2,4-triazol-3-yl]phenol, J1.086.626J, 11P-672

CAS Number
1009033-96-8
Molecular Formula
C14H12N4O2
Molecular Weight
268.09604 g/mol
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Technical Specifications

Molecular FormulaC14H12N4O2
Molecular Weight268.09604 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)97.2 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors5
Rotatable Bonds2
Exact Mass268.09604 Da
Heavy Atoms20
Complexity284.0
SMILESC1=CC(=CC=C1C2=NN=C(N2N)C3=CC=C(C=C3)O)O
InChIKeyKNVHHGXTGJXUAC-UHFFFAOYSA-N

Chemical Property Profile of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol

XLogP
1.8
TPSA (Topological Polar Surface Area)
97.2
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
5
Rotatable Bonds
2
Heavy Atoms
20
Complexity
284.0
Exact Mass
268.09604
Monoisotopic Mass
268.09604
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol. The TPSA of 97.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol. Following Lipinski's Rule of Five, 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol?

The CAS number of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol is 1009033-96-8.

What is the molecular formula of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol?

The molecular formula of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol is C14H12N4O2.

What is the molecular weight of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol?

The molecular weight of 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol is 268.09604 g/mol.

Where can I buy 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol?

You can request a quote for 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol?

Yes, CoreyChem provides custom synthesis services for 4-[4-amino-5-(4-hydroxyphenyl)-4H-1,2,4-triazol-3-yl]benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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