![Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester structure](/static/products/7295/729570-70-1.webp)
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester
TL;DR: Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester (CAS 729570-70-1) is a chemical compound with molecular formula C24H20ClF3N4O3 and molecular weight 504.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate
Also Known As: Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester, [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl] 2-[(4-dimethylaminophenyl)diazenyl]benzoate, [2-chloro-5-(trifluoromethyl)phenyl]carbamoylmethyl 2-(4-dimethylaminophenyl)diazenylbenzoate
| Molecular Formula | C24H20ClF3N4O3 |
|---|---|
| Molecular Weight | 504.12 g/mol |
| LogP | 6.6357 |
| Topological Polar Surface Area | 83.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.1176 |
| Heavy Atoms | 35 |
| Complexity | 1245.507 |
Chemical Identifiers
| CAS Number | 729570-70-1 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)N=NC2=CC=CC=C2C(=O)OCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl |
Product Overview
Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester (CAS 729570-70-1), with molecular formula C24H20ClF3N4O3 and molecular weight 504.12 g/mol. IUPAC: [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxoethyl] 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate.
Chemical Property Profile of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester
Property Insights of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester
The XLogP value of 6.6357 indicates that Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.36 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester. Following Lipinski's Rule of Five, Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester has 1 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 Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester?
The CAS number of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester is 729570-70-1.
What is the molecular formula of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester?
The molecular formula of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester is C24H20ClF3N4O3.
What is the molecular weight of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester?
The molecular weight of Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester is 504.12 g/mol.
Where can I buy Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester?
You can request a quote for Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-[2-[4-(dimethylamino)phenyl]diazenyl]-, 2-[[2-chloro-5-(trifluoromethyl)phenyl]amino]-2-oxoethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.