7-Chloroisatin
TL;DR: 7-Chloroisatin (CAS 3524-52-5) is a chemical compound with molecular formula C8H4ClNO2 and molecular weight 180.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-1H-indole-2,3-dione
Also Known As: 7-Chloroisatin, 7-chloro-1H-indole-2,3-dione, null, 7-chlorisatin, 7-chloroindoline-2,3-dione
| Molecular Formula | C8H4ClNO2 |
|---|---|
| Molecular Weight | 180.99 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.99306 |
| Heavy Atoms | 12 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 3524-52-5 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)Cl)NC(=O)C2=O |
| InChIKey | MPLXQMMMGDYXIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
7-Chloroisatin (CAS 3524-52-5), with molecular formula C8H4ClNO2 and molecular weight 180.99 g/mol. IUPAC: 7-chloro-1H-indole-2,3-dione.
Chemical Property Profile of 7-Chloroisatin
Property Insights of 7-Chloroisatin
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Chloroisatin. With a topological polar surface area (TPSA) of 46.2 Ų, 7-Chloroisatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloroisatin 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 7-Chloroisatin?
The CAS number of 7-Chloroisatin is 3524-52-5.
What is the molecular formula of 7-Chloroisatin?
The molecular formula of 7-Chloroisatin is C8H4ClNO2.
What is the molecular weight of 7-Chloroisatin?
The molecular weight of 7-Chloroisatin is 180.99 g/mol.
Where can I buy 7-Chloroisatin?
You can request a quote for 7-Chloroisatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloroisatin?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloroisatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.