(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid
TL;DR: (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid (CAS 47767-22-6) is a chemical compound with molecular formula C16H11NO4 and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)-2-phenylacetic acid
Also Known As: phthalimidophenylacetic acid, 2-phthalimido-2-phenylacetic acid, alpha-phthalimidophenylacetic acid, (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid, KST-1A4976
| Molecular Formula | C16H11NO4 |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.06882 |
| Heavy Atoms | 21 |
| Complexity | 431.0 |
Chemical Identifiers
| CAS Number | 47767-22-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C(=O)O)N2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | SYEYVZOVGXYKBL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid (CAS 47767-22-6), with molecular formula C16H11NO4 and molecular weight 281.07 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)-2-phenylacetic acid.
Chemical Property Profile of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid
Property Insights of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid. Following Lipinski's Rule of Five, (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid has 1 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 (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid?
The CAS number of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid is 47767-22-6.
What is the molecular formula of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid?
The molecular formula of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid is C16H11NO4.
What is the molecular weight of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid?
The molecular weight of (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid is 281.07 g/mol.
Where can I buy (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid?
You can request a quote for (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)(phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.