2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid
TL;DR: 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid (CAS 1008023-92-4) is a chemical compound with molecular formula C17H19NO5 and molecular weight 317.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid
Also Known As: 2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-(4-hydroxyphenyl)propanoic Acid, 2-(1,3-Dioxo-octahydro-isoindol-2-yl)-3-(4-hydroxy-phenyl)-propionic acid, 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid, 2-(1,3-dioxohexahydro-1H-isoindol-2(3H)-yl)-3-(4-hydroxyphenyl)propanoic acid
| Molecular Formula | C17H19NO5 |
|---|---|
| Molecular Weight | 317.13 g/mol |
| LogP | 1.5631 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 317.1263 |
| Heavy Atoms | 23 |
| Complexity | 614.88873 |
Chemical Identifiers
| CAS Number | 1008023-92-4 |
|---|---|
| SMILES | C1CCC2C(C1)C(=O)N(C2=O)C(CC3=CC=C(C=C3)O)C(=O)O |
Product Overview
2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid (CAS 1008023-92-4), with molecular formula C17H19NO5 and molecular weight 317.13 g/mol. IUPAC: 2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid.
Chemical Property Profile of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid
Property Insights of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid
The XLogP value of 1.5631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid. Following Lipinski's Rule of Five, 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid has 2 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 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid?
The CAS number of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid is 1008023-92-4.
What is the molecular formula of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid?
The molecular formula of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid is C17H19NO5.
What is the molecular weight of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid?
The molecular weight of 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid is 317.13 g/mol.
Where can I buy 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid?
You can request a quote for 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid 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-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-dioxooctahydro-2H-isoindol-2-yl)-3-(4-hydroxyphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.