2-(4-Acetyl-phenyl)-isoindole-1,3-dione
TL;DR: 2-(4-Acetyl-phenyl)-isoindole-1,3-dione (CAS 40101-59-5) is a chemical compound with molecular formula C16H11NO3 and molecular weight 265.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-acetylphenyl)isoindole-1,3-dione
Also Known As: 2-(4-acetylphenyl)-1H-isoindole-1,3(2H)-dione, 2-(4-acetylphenyl)isoindoline-1,3-dione, Maybridge1_005696, 2-(4-acetylphenyl)isoindole-1,3-dione, AKOS BC-1756
| Molecular Formula | C16H11NO3 |
|---|---|
| Molecular Weight | 265.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 265.07388 |
| Heavy Atoms | 20 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 40101-59-5 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O |
| InChIKey | IZYOEWPKMOPSSP-UHFFFAOYSA-N |
Product Overview
2-(4-Acetyl-phenyl)-isoindole-1,3-dione (CAS 40101-59-5), with molecular formula C16H11NO3 and molecular weight 265.07 g/mol. IUPAC: 2-(4-acetylphenyl)isoindole-1,3-dione.
Chemical Property Profile of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione
Property Insights of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Acetyl-phenyl)-isoindole-1,3-dione. With a topological polar surface area (TPSA) of 54.5 Ų, 2-(4-Acetyl-phenyl)-isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Acetyl-phenyl)-isoindole-1,3-dione has 0 hydrogen bond donor(s) and 3 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-(4-Acetyl-phenyl)-isoindole-1,3-dione?
The CAS number of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione is 40101-59-5.
What is the molecular formula of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione?
The molecular formula of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione is C16H11NO3.
What is the molecular weight of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione?
The molecular weight of 2-(4-Acetyl-phenyl)-isoindole-1,3-dione is 265.07 g/mol.
Where can I buy 2-(4-Acetyl-phenyl)-isoindole-1,3-dione?
You can request a quote for 2-(4-Acetyl-phenyl)-isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Acetyl-phenyl)-isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Acetyl-phenyl)-isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.