N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide
TL;DR: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide (CAS 432011-06-8) is a chemical compound with molecular formula C21H17IN4O and molecular weight 468.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide
Also Known As: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide, N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-iodobenzamide, N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodo-benzamide, N-[2-(4-ethylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-iodobenzamide
| Molecular Formula | C21H17IN4O |
|---|---|
| Molecular Weight | 468.04 g/mol |
| LogP | 4.8398 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 468.0447 |
| Heavy Atoms | 27 |
| Complexity | 1118.7019 |
Chemical Identifiers
| CAS Number | 432011-06-8 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC=CC=C4I |
Product Overview
N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide (CAS 432011-06-8), with molecular formula C21H17IN4O and molecular weight 468.04 g/mol. IUPAC: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide.
Chemical Property Profile of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide
Property Insights of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide
The XLogP value of 4.8398 indicates that N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide 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 N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide?
The CAS number of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide is 432011-06-8.
What is the molecular formula of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide?
The molecular formula of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide is C21H17IN4O.
What is the molecular weight of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide?
The molecular weight of N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide is 468.04 g/mol.
Where can I buy N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide?
You can request a quote for N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-ethylphenyl)benzotriazol-5-yl]-2-iodobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.