![Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate structure](/static/products/3576/357613-50-4.webp)
Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate
TL;DR: Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate (CAS 357613-50-4) is a chemical compound with molecular formula C20H28N2O4 and molecular weight 360.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate
Also Known As: BIM-0042754.P001, ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate, A2336/0098588, ethyl 4-[3-(heptylamino)-2,5-dioxoazolidinyl]benzoate, ethyl 4-(3-(heptylamino)-2,5-dioxopyrrolidin-1-yl)benzoate
| Molecular Formula | C20H28N2O4 |
|---|---|
| Molecular Weight | 360.20 g/mol |
| LogP | 3.0552 |
| Topological Polar Surface Area | 75.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 360.2049 |
| Heavy Atoms | 26 |
| Complexity | 627.2033 |
Chemical Identifiers
| CAS Number | 357613-50-4 |
|---|---|
| SMILES | CCCCCCCNC1CC(=O)N(C1=O)C2=CC=C(C=C2)C(=O)OCC |
Product Overview
Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate (CAS 357613-50-4), with molecular formula C20H28N2O4 and molecular weight 360.20 g/mol. IUPAC: ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate
Property Insights of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate
The XLogP value of 3.0552 indicates that Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate. Following Lipinski's Rule of Five, Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]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-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate?
The CAS number of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate is 357613-50-4.
What is the molecular formula of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate?
The molecular formula of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate is C20H28N2O4.
What is the molecular weight of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate?
The molecular weight of Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate is 360.20 g/mol.
Where can I buy Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate?
You can request a quote for Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]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-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[3-(heptylamino)-2,5-dioxopyrrolidin-1-yl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.