Acetylisatin
TL;DR: Acetylisatin (CAS 574-17-4) is a chemical compound with molecular formula C10H7NO3 and molecular weight 189.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-acetylindole-2,3-dione
Also Known As: 1-Acetylisatin, N-Acetylisatin, Acetylisatin, 1-acetylindoline-2,3-dione, 1-Acetyl-1H-indole-2,3-dione
| Molecular Formula | C10H7NO3 |
|---|---|
| Molecular Weight | 189.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 189.04259 |
| Heavy Atoms | 14 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 574-17-4 |
|---|---|
| SMILES | CC(=O)N1C2=CC=CC=C2C(=O)C1=O |
| InChIKey | LPGDEHBASRKTDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetylisatin (CAS 574-17-4), with molecular formula C10H7NO3 and molecular weight 189.04 g/mol. IUPAC: 1-acetylindole-2,3-dione.
Chemical Property Profile of Acetylisatin
Property Insights of Acetylisatin
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetylisatin. With a topological polar surface area (TPSA) of 54.5 Ų, Acetylisatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetylisatin 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 Acetylisatin?
The CAS number of Acetylisatin is 574-17-4.
What is the molecular formula of Acetylisatin?
The molecular formula of Acetylisatin is C10H7NO3.
What is the molecular weight of Acetylisatin?
The molecular weight of Acetylisatin is 189.04 g/mol.
Where can I buy Acetylisatin?
You can request a quote for Acetylisatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetylisatin?
Yes, KEHONG BIO provides custom synthesis services for Acetylisatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.