2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide
TL;DR: 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide (CAS 309292-60-2) is a chemical compound with molecular formula C21H16ClN5O4 and molecular weight 437.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide
Also Known As: BAS 00858798, 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide, A2175/0091381, 2-Chloro-N-[2-(4-ethoxy-phenyl)-2H-benzotriazol-5-yl]-5-nitro-benzamide, 2-chloro-N-[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]-5-nitrobenzamide
| Molecular Formula | C21H16ClN5O4 |
|---|---|
| Molecular Weight | 437.09 g/mol |
| LogP | 4.6331 |
| Topological Polar Surface Area | 112.18 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 437.08908 |
| Heavy Atoms | 31 |
| Complexity | 1286.9247 |
Chemical Identifiers
| CAS Number | 309292-60-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl |
Product Overview
2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide (CAS 309292-60-2), with molecular formula C21H16ClN5O4 and molecular weight 437.09 g/mol. IUPAC: 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide.
Chemical Property Profile of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide
Property Insights of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide
The XLogP value of 4.6331 indicates that 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.18 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide. Following Lipinski's Rule of Five, 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide has 1 hydrogen bond donor(s) and 6 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-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide?
The CAS number of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide is 309292-60-2.
What is the molecular formula of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide?
The molecular formula of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide is C21H16ClN5O4.
What is the molecular weight of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide?
The molecular weight of 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide is 437.09 g/mol.
Where can I buy 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide?
You can request a quote for 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-5-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.