Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate
TL;DR: Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate (CAS 478248-76-9) is a chemical compound with molecular formula C24H17Cl2N3O4 and molecular weight 481.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate
Also Known As: 9P-753, Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate, ethyl 4-{4-[2-chloro-4-(4-chlorophenoxy)benzoyl]-1H-1,2,3-triazol-1-yl}benzenecarboxylate, ethyl 4-{4-[2-chloro-4-(4-chlorophenoxy)benzoyl]-1H-1,2,3-triazol-1-yl}benzoate, ethyl4-{4-[2-chloro-4-(4-chlorophenoxy)benzoyl]-1H-1,2,3-triazol-1-yl}benzoate
| Molecular Formula | C24H17Cl2N3O4 |
|---|---|
| Molecular Weight | 481.06 g/mol |
| LogP | 5.7741 |
| Topological Polar Surface Area | 83.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 481.0596 |
| Heavy Atoms | 33 |
| Complexity | 1302.3011 |
Chemical Identifiers
| CAS Number | 478248-76-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C=C(N=N2)C(=O)C3=C(C=C(C=C3)OC4=CC=C(C=C4)Cl)Cl |
Product Overview
Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate (CAS 478248-76-9), with molecular formula C24H17Cl2N3O4 and molecular weight 481.06 g/mol. IUPAC: ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate.
Chemical Property Profile of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate
Property Insights of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate
The XLogP value of 5.7741 indicates that Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.31 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate. Following Lipinski's Rule of Five, Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate?
The CAS number of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate is 478248-76-9.
What is the molecular formula of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate?
The molecular formula of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate is C24H17Cl2N3O4.
What is the molecular weight of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate?
The molecular weight of Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate is 481.06 g/mol.
Where can I buy Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate?
You can request a quote for Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[4-[2-chloro-4-(4-chlorophenoxy)benzoyl]triazol-1-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.