![Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate structure](/static/products/4729/472979-83-2.webp)
Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate
TL;DR: Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate (CAS 472979-83-2) is a chemical compound with molecular formula C20H19FN2O4 and molecular weight 370.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-[(4-fluorophenyl)methylamino]-2,5-dioxopyrrolidin-1-yl]benzoate
Also Known As: AJ-292/13607122, AB00101282-01, ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate, ethyl 4-[3-[(4-fluorophenyl)methylamino]-2,5-dioxopyrrolidin-1-yl]benzoate, ethyl 4-(3-((4-fluorobenzyl)amino)-2,5-dioxopyrrolidin-1-yl)benzoate
| Molecular Formula | C20H19FN2O4 |
|---|---|
| Molecular Weight | 370.13 g/mol |
| LogP | 2.4241 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 370.13287 |
| Heavy Atoms | 27 |
| Complexity | 849.29034 |
Chemical Identifiers
| CAS Number | 472979-83-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=O)CC(C2=O)NCC3=CC=C(C=C3)F |
Product Overview
Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate (CAS 472979-83-2), with molecular formula C20H19FN2O4 and molecular weight 370.13 g/mol. IUPAC: ethyl 4-[3-[(4-fluorophenyl)methylamino]-2,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate
Property Insights of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate
The XLogP value of 2.4241 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate. Following Lipinski's Rule of Five, Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate has 1 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 Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate?
The CAS number of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate is 472979-83-2.
What is the molecular formula of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate?
The molecular formula of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate is C20H19FN2O4.
What is the molecular weight of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate?
The molecular weight of Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate is 370.13 g/mol.
Where can I buy Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate?
You can request a quote for Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}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-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-{3-[(4-fluorobenzyl)amino]-2,5-dioxo-1-pyrrolidinyl}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.