4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine
TL;DR: 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine (CAS 898620-14-9) is a chemical compound with molecular formula C14H13BrN4O and molecular weight 332.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine
Also Known As: 4-bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine, 4-bromo-2-(4-ethoxyphenyl)-2H-benzotriazol-5-amine, BB 0245849, AP-970/43482681, 4-Bromo-2-(4-ethoxy-phenyl)-2H-benzotriazo l-5-ylamine
| Molecular Formula | C14H13BrN4O |
|---|---|
| Molecular Weight | 332.03 g/mol |
| LogP | 3.1639 |
| Topological Polar Surface Area | 65.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 332.02728 |
| Heavy Atoms | 20 |
| Complexity | 751.70496 |
Chemical Identifiers
| CAS Number | 898620-14-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2N=C3C=CC(=C(C3=N2)Br)N |
Product Overview
4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine (CAS 898620-14-9), with molecular formula C14H13BrN4O and molecular weight 332.03 g/mol. IUPAC: 4-bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine.
Chemical Property Profile of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine
Property Insights of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine
The XLogP value of 3.1639 indicates that 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine. Following Lipinski's Rule of Five, 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine has 1 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 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine?
The CAS number of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine is 898620-14-9.
What is the molecular formula of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine?
The molecular formula of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine is C14H13BrN4O.
What is the molecular weight of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine?
The molecular weight of 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine is 332.03 g/mol.
Where can I buy 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine?
You can request a quote for 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-(4-ethoxyphenyl)benzotriazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.