2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate
TL;DR: 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate (CAS 494826-23-2) is a chemical compound with molecular formula C20H21NO5S and molecular weight 387.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate
Also Known As: 2-(1,3-dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate, 2-(1,3-dioxoisoindolin-2-yl)ethyl 2,5-diethylbenzenesulfonate, F1565-0090, 2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)ethyl 2,5-diethylbenzene-1-sulfonate
| Molecular Formula | C20H21NO5S |
|---|---|
| Molecular Weight | 387.11 g/mol |
| LogP | 2.8129 |
| Topological Polar Surface Area | 80.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 387.11404 |
| Heavy Atoms | 27 |
| Complexity | 962.1817 |
Chemical Identifiers
| CAS Number | 494826-23-2 |
|---|---|
| SMILES | CCC1=CC(=C(C=C1)CC)S(=O)(=O)OCCN2C(=O)C3=CC=CC=C3C2=O |
Product Overview
2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate (CAS 494826-23-2), with molecular formula C20H21NO5S and molecular weight 387.11 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate.
Chemical Property Profile of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate
Property Insights of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate
The XLogP value of 2.8129 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate. The TPSA of 80.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate. Following Lipinski's Rule of Five, 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate has 0 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 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate?
The CAS number of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate is 494826-23-2.
What is the molecular formula of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate?
The molecular formula of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate is C20H21NO5S.
What is the molecular weight of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate?
The molecular weight of 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate is 387.11 g/mol.
Where can I buy 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate?
You can request a quote for 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Dioxoisoindol-2-yl)ethyl 2,5-diethylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.