Propyl 2-(4-chloroanilino)-2-oxoacetate
TL;DR: Propyl 2-(4-chloroanilino)-2-oxoacetate (CAS 6519-68-2) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 2-(4-chloroanilino)-2-oxoacetate
Also Known As: propyl 2-(4-chloroanilino)-2-oxoacetate, Propyl (4-chloroanilino)(oxo)acetate, propyl [N-(4-chlorophenyl)carbamoyl]formate, Oxalic acid, monoamide, N-(4-chlorophenyl)-, propyl ester, RefChem:375520
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 2.2317 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 375.32098 |
Chemical Identifiers
| CAS Number | 6519-68-2 |
|---|---|
| SMILES | CCCOC(=O)C(=O)NC1=CC=C(C=C1)Cl |
Product Overview
Propyl 2-(4-chloroanilino)-2-oxoacetate (CAS 6519-68-2), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: propyl 2-(4-chloroanilino)-2-oxoacetate.
Chemical Property Profile of Propyl 2-(4-chloroanilino)-2-oxoacetate
Property Insights of Propyl 2-(4-chloroanilino)-2-oxoacetate
The XLogP value of 2.2317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl 2-(4-chloroanilino)-2-oxoacetate. With a topological polar surface area (TPSA) of 55.4 Ų, Propyl 2-(4-chloroanilino)-2-oxoacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 2-(4-chloroanilino)-2-oxoacetate has 1 hydrogen bond donor(s) and 3 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 Propyl 2-(4-chloroanilino)-2-oxoacetate?
The CAS number of Propyl 2-(4-chloroanilino)-2-oxoacetate is 6519-68-2.
What is the molecular formula of Propyl 2-(4-chloroanilino)-2-oxoacetate?
The molecular formula of Propyl 2-(4-chloroanilino)-2-oxoacetate is C11H12ClNO3.
What is the molecular weight of Propyl 2-(4-chloroanilino)-2-oxoacetate?
The molecular weight of Propyl 2-(4-chloroanilino)-2-oxoacetate is 241.05 g/mol.
Where can I buy Propyl 2-(4-chloroanilino)-2-oxoacetate?
You can request a quote for Propyl 2-(4-chloroanilino)-2-oxoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 2-(4-chloroanilino)-2-oxoacetate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 2-(4-chloroanilino)-2-oxoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.