![[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate structure](/static/products/7295/729573-57-3.webp)
[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
TL;DR: [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate (CAS 729573-57-3) is a chemical compound with molecular formula C25H19ClF3N3O6 and molecular weight 549.09 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-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
Also Known As: [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate|{[2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL]CARBAMOYL}(PHENYL)METHYL 2-[(3-METHYL-4-NITROPHENYL)FORMAMIDO]ACETATE|2-(2-chloro-5-(trifluoromethyl)phenylamino)-2-oxo-1-phenylethyl 2-(3-methyl-4-nitrobenzamido)acetate|SMR000150666|MLS000571074|MLS002636917|cid_4437145|BDBM50322731
| Molecular Formula | C25H19ClF3N3O6 |
|---|---|
| Molecular Weight | 549.09 g/mol |
| LogP | 5.22842 |
| Topological Polar Surface Area | 127.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 549.09143 |
| Heavy Atoms | 38 |
| Complexity | 1382.5017 |
Chemical Identifiers
| CAS Number | 729573-57-3 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=O)NCC(=O)OC(C2=CC=CC=C2)C(=O)NC3=C(C=CC(=C3)C(F)(F)F)Cl)[N+](=O)[O-] |
Product Overview
[2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate (CAS 729573-57-3), with molecular formula C25H19ClF3N3O6 and molecular weight 549.09 g/mol. IUPAC: [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate.
Chemical Property Profile of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
Property Insights of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate
The XLogP value of 5.22842 indicates that [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.64 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate. Following Lipinski's Rule of Five, [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate has 2 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 [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
The CAS number of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is 729573-57-3.
What is the molecular formula of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
The molecular formula of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is C25H19ClF3N3O6.
What is the molecular weight of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
The molecular weight of [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate is 549.09 g/mol.
Where can I buy [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
You can request a quote for [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate?
Yes, KEHONG BIO provides custom synthesis services for [2-[2-chloro-5-(trifluoromethyl)anilino]-2-oxo-1-phenylethyl] 2-[(3-methyl-4-nitrobenzoyl)amino]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.