3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate
TL;DR: 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate (CAS 352005-52-8) is a chemical compound with molecular formula C22H23NO4 and molecular weight 365.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,3-dioxoisoindol-2-yl)phenyl] octanoate
Also Known As: [3-(1,3-dioxoisoindol-2-yl)phenyl] octanoate|3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate|AK-918/11667371|3-(1,3-dioxobenzo[c]azolidin-2-yl)phenyl octanoate
| Molecular Formula | C22H23NO4 |
|---|---|
| Molecular Weight | 365.16 g/mol |
| LogP | 4.7531 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 365.16272 |
| Heavy Atoms | 27 |
| Complexity | 823.89624 |
Chemical Identifiers
| CAS Number | 352005-52-8 |
|---|---|
| SMILES | CCCCCCCC(=O)OC1=CC=CC(=C1)N2C(=O)C3=CC=CC=C3C2=O |
Product Overview
3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate (CAS 352005-52-8), with molecular formula C22H23NO4 and molecular weight 365.16 g/mol. IUPAC: [3-(1,3-dioxoisoindol-2-yl)phenyl] octanoate.
Chemical Property Profile of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate
Property Insights of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate
The XLogP value of 4.7531 indicates that 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate 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 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate. Following Lipinski's Rule of Five, 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate 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 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate?
The CAS number of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate is 352005-52-8.
What is the molecular formula of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate?
The molecular formula of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate is C22H23NO4.
What is the molecular weight of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate?
The molecular weight of 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate is 365.16 g/mol.
Where can I buy 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate?
You can request a quote for 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl octanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.