1H-Indole-2,3-dione, 6-bromo-
TL;DR: 1H-Indole-2,3-dione, 6-bromo- (CAS 6326-79-0) is a chemical compound with molecular formula C8H4BrNO2 and molecular weight 224.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-1H-indole-2,3-dione
Also Known As: 6-bromoisatin, 6-bromo-1H-indole-2,3-dione, 6-bromoindoline-2,3-dione, 6-Bromo Isatin, 6-Bromo-isatin
| Molecular Formula | C8H4BrNO2 |
|---|---|
| Molecular Weight | 224.94 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.94254 |
| Heavy Atoms | 12 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 6326-79-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1Br)NC(=O)C2=O |
| InChIKey | HVPQMLZLINVIHW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-Indole-2,3-dione, 6-bromo- (CAS 6326-79-0), with molecular formula C8H4BrNO2 and molecular weight 224.94 g/mol. IUPAC: 6-bromo-1H-indole-2,3-dione.
Chemical Property Profile of 1H-Indole-2,3-dione, 6-bromo-
Property Insights of 1H-Indole-2,3-dione, 6-bromo-
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Indole-2,3-dione, 6-bromo-. With a topological polar surface area (TPSA) of 46.2 Ų, 1H-Indole-2,3-dione, 6-bromo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Indole-2,3-dione, 6-bromo- 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 1H-Indole-2,3-dione, 6-bromo-?
The CAS number of 1H-Indole-2,3-dione, 6-bromo- is 6326-79-0.
What is the molecular formula of 1H-Indole-2,3-dione, 6-bromo-?
The molecular formula of 1H-Indole-2,3-dione, 6-bromo- is C8H4BrNO2.
What is the molecular weight of 1H-Indole-2,3-dione, 6-bromo-?
The molecular weight of 1H-Indole-2,3-dione, 6-bromo- is 224.94 g/mol.
Where can I buy 1H-Indole-2,3-dione, 6-bromo-?
You can request a quote for 1H-Indole-2,3-dione, 6-bromo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Indole-2,3-dione, 6-bromo-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Indole-2,3-dione, 6-bromo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.