2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide
TL;DR: 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide (CAS 431922-35-9) is a chemical compound with molecular formula C21H16Cl2N4O2 and molecular weight 426.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide
Also Known As: 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide, 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)-2H-benzotriazol-5-yl]-4-methylbenzamide, 2-chloro-N-[2-(3-chloro-4-methoxy-phenyl)benzotriazol-5-yl]-4-methyl-benzamide, 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)-2H-1,2,3-benzotriazol-5-yl]-4-methylbenzamide
| Molecular Formula | C21H16Cl2N4O2 |
|---|---|
| Molecular Weight | 426.07 g/mol |
| LogP | 5.29662 |
| Topological Polar Surface Area | 69.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.06503 |
| Heavy Atoms | 29 |
| Complexity | 1236.8137 |
Chemical Identifiers
| CAS Number | 431922-35-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(=O)NC2=CC3=NN(N=C3C=C2)C4=CC(=C(C=C4)OC)Cl)Cl |
Product Overview
2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide (CAS 431922-35-9), with molecular formula C21H16Cl2N4O2 and molecular weight 426.07 g/mol. IUPAC: 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide.
Chemical Property Profile of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide
Property Insights of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide
The XLogP value of 5.29662 indicates that 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.04 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide. Following Lipinski's Rule of Five, 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide?
The CAS number of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide is 431922-35-9.
What is the molecular formula of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide?
The molecular formula of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide is C21H16Cl2N4O2.
What is the molecular weight of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide?
The molecular weight of 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide is 426.07 g/mol.
Where can I buy 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide?
You can request a quote for 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide 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-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-[2-(3-chloro-4-methoxyphenyl)benzotriazol-5-yl]-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.