![ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate structure](/static/products/372/372184-20-8.png)
ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate
TL;DR: ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate (CAS 372184-20-8) is a chemical compound with molecular formula C21H20N2O5 and molecular weight 380.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]benzoate
Also Known As: ethyl 4-(4-(1,3-dioxoisoindolin-2-yl)butanamido)benzoate, ethyl 4-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]benzoate, ethyl 4-[4-(1,3-dioxobenzo[c]azolidin-2-yl)butanoylamino]benzoate, ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate
| Molecular Formula | C21H20N2O5 |
|---|---|
| Molecular Weight | 380.14 g/mol |
| LogP | 2.8782 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 380.1372 |
| Heavy Atoms | 28 |
| Complexity | 885.64813 |
Chemical Identifiers
| CAS Number | 372184-20-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCN2C(=O)C3=CC=CC=C3C2=O |
Product Overview
ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate (CAS 372184-20-8), with molecular formula C21H20N2O5 and molecular weight 380.14 g/mol. IUPAC: ethyl 4-[4-(1,3-dioxoisoindol-2-yl)butanoylamino]benzoate.
Chemical Property Profile of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate
Property Insights of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate
The XLogP value of 2.8782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate. Following Lipinski's Rule of Five, ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}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-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate?
The CAS number of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate is 372184-20-8.
What is the molecular formula of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate?
The molecular formula of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate is C21H20N2O5.
What is the molecular weight of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate?
The molecular weight of ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate is 380.14 g/mol.
Where can I buy ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate?
You can request a quote for ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}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-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-{[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanoyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.