6-Iodo-4-trifluoromethyl-isatin
TL;DR: 6-Iodo-4-trifluoromethyl-isatin (CAS 259667-71-5) is a chemical compound with molecular formula C9H3F3INO2 and molecular weight 340.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-iodo-4-(trifluoromethyl)-1H-indole-2,3-dione
Also Known As: 6-Iodo-4-trifluoromethyl-isatin, 6-iodo-4-(trifluoromethyl)indoline-2,3-dione, 4-trifluoromethyl-6-iodoisatin, 6-iodo-4-(trifluoromethyl)-1H-indole-2,3-dione, 6-iodo-4-trifluoromethyl-1h-indole-2,3-dione
| Molecular Formula | C9H3F3INO2 |
|---|---|
| Molecular Weight | 340.92 g/mol |
| LogP | 2.4448 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 340.91605 |
| Heavy Atoms | 16 |
| Complexity | 510.21094 |
Chemical Identifiers
| CAS Number | 259667-71-5 |
|---|---|
| SMILES | C1=C(C=C2C(=C1C(F)(F)F)C(=O)C(=O)N2)I |
Product Overview
6-Iodo-4-trifluoromethyl-isatin (CAS 259667-71-5), with molecular formula C9H3F3INO2 and molecular weight 340.92 g/mol. IUPAC: 6-iodo-4-(trifluoromethyl)-1H-indole-2,3-dione.
Chemical Property Profile of 6-Iodo-4-trifluoromethyl-isatin
Property Insights of 6-Iodo-4-trifluoromethyl-isatin
The XLogP value of 2.4448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Iodo-4-trifluoromethyl-isatin. With a topological polar surface area (TPSA) of 46.17 Ų, 6-Iodo-4-trifluoromethyl-isatin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Iodo-4-trifluoromethyl-isatin 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 6-Iodo-4-trifluoromethyl-isatin?
The CAS number of 6-Iodo-4-trifluoromethyl-isatin is 259667-71-5.
What is the molecular formula of 6-Iodo-4-trifluoromethyl-isatin?
The molecular formula of 6-Iodo-4-trifluoromethyl-isatin is C9H3F3INO2.
What is the molecular weight of 6-Iodo-4-trifluoromethyl-isatin?
The molecular weight of 6-Iodo-4-trifluoromethyl-isatin is 340.92 g/mol.
Where can I buy 6-Iodo-4-trifluoromethyl-isatin?
You can request a quote for 6-Iodo-4-trifluoromethyl-isatin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Iodo-4-trifluoromethyl-isatin?
Yes, KEHONG BIO provides custom synthesis services for 6-Iodo-4-trifluoromethyl-isatin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.