Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate
TL;DR: Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate (CAS 330989-75-8) is a chemical compound with molecular formula C17H11Cl2NO4 and molecular weight 363.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate
Also Known As: BAS 00315827, ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate, AB00079293-01, ethyl 2-(2,5-dichlorophenyl)-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate, ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindoline-5-carboxylate
| Molecular Formula | C17H11Cl2NO4 |
|---|---|
| Molecular Weight | 363.01 g/mol |
| LogP | 3.9707 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.0065 |
| Heavy Atoms | 24 |
| Complexity | 878.8894 |
Chemical Identifiers
| CAS Number | 330989-75-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)C3=C(C=CC(=C3)Cl)Cl |
Product Overview
Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate (CAS 330989-75-8), with molecular formula C17H11Cl2NO4 and molecular weight 363.01 g/mol. IUPAC: ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate.
Chemical Property Profile of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate
Property Insights of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate
The XLogP value of 3.9707 indicates that Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate has 0 hydrogen bond donor(s) and 4 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 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate?
The CAS number of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate is 330989-75-8.
What is the molecular formula of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate?
The molecular formula of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate is C17H11Cl2NO4.
What is the molecular weight of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate?
The molecular weight of Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate is 363.01 g/mol.
Where can I buy Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate?
You can request a quote for Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(2,5-dichlorophenyl)-1,3-dioxoisoindole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.