4-Bromo-5-methoxyisatin
TL;DR: 4-Bromo-5-methoxyisatin (CAS 130420-75-6) is a chemical compound with molecular formula C9H6BrNO3 and molecular weight 254.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-5-methoxy-1H-indole-2,3-dione
Also Known As: 4-bromo-5-methoxyisatin, 4-bromo-5-methoxy-1H-indole-2,3-dione, 4-BROMO-5-METHOXYINDOLINE-2,3-DIONE, 4-bromo-5-methoxy-2,3-dihydro-1H-indole-2,3-dione
| Molecular Formula | C9H6BrNO3 |
|---|---|
| Molecular Weight | 254.95 g/mol |
| LogP | 1.5925 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.95311 |
| Heavy Atoms | 14 |
| Complexity | 441.92838 |
Chemical Identifiers
| CAS Number | 130420-75-6 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)NC(=O)C2=O)Br |
Product Overview
4-Bromo-5-methoxyisatin (CAS 130420-75-6), with molecular formula C9H6BrNO3 and molecular weight 254.95 g/mol. IUPAC: 4-bromo-5-methoxy-1H-indole-2,3-dione.
Chemical Property Profile of 4-Bromo-5-methoxyisatin
Property Insights of 4-Bromo-5-methoxyisatin
The XLogP value of 1.5925 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-5-methoxyisatin. With a topological polar surface area (TPSA) of 55.4 Ų, 4-Bromo-5-methoxyisatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-5-methoxyisatin has 1 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 4-Bromo-5-methoxyisatin?
The CAS number of 4-Bromo-5-methoxyisatin is 130420-75-6.
What is the molecular formula of 4-Bromo-5-methoxyisatin?
The molecular formula of 4-Bromo-5-methoxyisatin is C9H6BrNO3.
What is the molecular weight of 4-Bromo-5-methoxyisatin?
The molecular weight of 4-Bromo-5-methoxyisatin is 254.95 g/mol.
Where can I buy 4-Bromo-5-methoxyisatin?
You can request a quote for 4-Bromo-5-methoxyisatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-5-methoxyisatin?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-5-methoxyisatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.