4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
TL;DR: 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid (CAS 866144-54-9) is a chemical compound with molecular formula C16H21NO3 and molecular weight 275.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-(3-oxo-1H-isoindol-2-yl)hexanoic acid
Also Known As: Bionet2_001169, 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid, 4-ethyl-3-(1-oxo-2,3-dihydro-1H-isoindol-2-yl)hexanoic acid, 4-ethyl-3-(3-oxo-1H-isoindol-2-yl)hexanoic acid, 4-ethyl-3-(1-oxoisoindolin-2-yl)hexanoic acid
| Molecular Formula | C16H21NO3 |
|---|---|
| Molecular Weight | 275.15 g/mol |
| LogP | 2.9219 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 275.15213 |
| Heavy Atoms | 20 |
| Complexity | 508.19836 |
Chemical Identifiers
| CAS Number | 866144-54-9 |
|---|---|
| SMILES | CCC(CC)C(CC(=O)O)N1CC2=CC=CC=C2C1=O |
Product Overview
4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid (CAS 866144-54-9), with molecular formula C16H21NO3 and molecular weight 275.15 g/mol. IUPAC: 4-ethyl-3-(3-oxo-1H-isoindol-2-yl)hexanoic acid.
Chemical Property Profile of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
Property Insights of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid
The XLogP value of 2.9219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid. With a topological polar surface area (TPSA) of 57.61 Ų, 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid has 1 hydrogen bond donor(s) and 2 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 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
The CAS number of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid is 866144-54-9.
What is the molecular formula of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
The molecular formula of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid is C16H21NO3.
What is the molecular weight of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
The molecular weight of 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid is 275.15 g/mol.
Where can I buy 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
You can request a quote for 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-ethyl-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.