2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
TL;DR: 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate (CAS 6576-61-0) is a chemical compound with molecular formula C16H13ClF2N2O4 and molecular weight 370.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,4-difluoroanilino)-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate
Also Known As: AB00712677-01, T0508-9754, [2-(2,4-difluoroanilino)-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate, 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
| Molecular Formula | C16H13ClF2N2O4 |
|---|---|
| Molecular Weight | 370.05 g/mol |
| LogP | 3.0045 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.0532 |
| Heavy Atoms | 25 |
| Complexity | 830.0223 |
Chemical Identifiers
| CAS Number | 6576-61-0 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)OCC(=O)NC2=C(C=C(C=C2)F)F)Cl)N |
Product Overview
2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate (CAS 6576-61-0), with molecular formula C16H13ClF2N2O4 and molecular weight 370.05 g/mol. IUPAC: [2-(2,4-difluoroanilino)-2-oxoethyl] 4-amino-5-chloro-2-methoxybenzoate.
Chemical Property Profile of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
Property Insights of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate
The XLogP value of 3.0045 indicates that 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate. Following Lipinski's Rule of Five, 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate has 2 hydrogen bond donor(s) and 5 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-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
The CAS number of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is 6576-61-0.
What is the molecular formula of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
The molecular formula of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is C16H13ClF2N2O4.
What is the molecular weight of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
The molecular weight of 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate is 370.05 g/mol.
Where can I buy 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
You can request a quote for 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4-Difluoroanilino)-2-oxoethyl 4-amino-5-chloro-2-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.