![2-benzo[e]benzotriazol-2-ylaniline structure](/static/products/764/76429-34-0.png)
2-benzo[e]benzotriazol-2-ylaniline
TL;DR: 2-benzo[e]benzotriazol-2-ylaniline (CAS 76429-34-0) is a chemical compound with molecular formula C16H12N4 and molecular weight 260.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzo[e]benzotriazol-2-ylaniline
Also Known As: 2-benzo[e]benzotriazol-2-ylaniline, 2-(2h-naphtho[1,2-d][1,2,3]triazol-2-yl)aniline, 2-benzo[e]benzotriazol-2-yl-aniline, 2-(2-AMINOPHENYL)-2H-NAPHTHO(1,2-D)TRIAZOLE, 2-naphtho[1,2-d][1,2,3]triazol-2-yl-aniline
| Molecular Formula | C16H12N4 |
|---|---|
| Molecular Weight | 260.11 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 56.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.1062 |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 76429-34-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC3=NN(N=C32)C4=CC=CC=C4N |
| InChIKey | WMCKDNPVZDYHGP-UHFFFAOYSA-N |
Product Overview
2-benzo[e]benzotriazol-2-ylaniline (CAS 76429-34-0), with molecular formula C16H12N4 and molecular weight 260.11 g/mol. IUPAC: 2-benzo[e]benzotriazol-2-ylaniline.
Chemical Property Profile of 2-benzo[e]benzotriazol-2-ylaniline
Property Insights of 2-benzo[e]benzotriazol-2-ylaniline
The XLogP value of 3.9 indicates that 2-benzo[e]benzotriazol-2-ylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.7 Ų, 2-benzo[e]benzotriazol-2-ylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-benzo[e]benzotriazol-2-ylaniline 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-benzo[e]benzotriazol-2-ylaniline?
The CAS number of 2-benzo[e]benzotriazol-2-ylaniline is 76429-34-0.
What is the molecular formula of 2-benzo[e]benzotriazol-2-ylaniline?
The molecular formula of 2-benzo[e]benzotriazol-2-ylaniline is C16H12N4.
What is the molecular weight of 2-benzo[e]benzotriazol-2-ylaniline?
The molecular weight of 2-benzo[e]benzotriazol-2-ylaniline is 260.11 g/mol.
Where can I buy 2-benzo[e]benzotriazol-2-ylaniline?
You can request a quote for 2-benzo[e]benzotriazol-2-ylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-benzo[e]benzotriazol-2-ylaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-benzo[e]benzotriazol-2-ylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.