![2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide structure](/static/products/105/1052408-72-6.webp)
2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide
TL;DR: 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide (CAS 1052408-72-6) is a chemical compound with molecular formula C15H13BrFN3O and molecular weight 349.0226 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-fluoro-N-(3-imino-1H-isoindol-2-yl)benzamide;hydrobromide
Also Known As: 2-[(4-fluorobenzoyl)amino]-1-isoindoliniminium bromide, 4-fluoro-N-(1-iminoisoindolin-2-yl)benzamide hydrobromide, 4-fluoro-N-(3-imino-1H-isoindol-2-yl)benzamide hydrobromide
Technical Specifications
| Molecular Formula | C15H13BrFN3O |
| Molecular Weight | 349.0226 g/mol |
| XLogP | 2.88957 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 349.0226 Da |
| Heavy Atoms | 21 |
| Complexity | 393.0 |
| SMILES | C1C2=CC=CC=C2C(=N)N1NC(=O)C3=CC=C(C=C3)F.Br |
| InChIKey | CREPCBUYNLRQER-UHFFFAOYSA-N |
Chemical Property Profile of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide
Property Insights of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide
The XLogP value of 2.88957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide. With a topological polar surface area (TPSA) of 56.2 Ų, 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide?
The CAS number of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide is 1052408-72-6.
What is the molecular formula of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide?
The molecular formula of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide is C15H13BrFN3O.
What is the molecular weight of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide?
The molecular weight of 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide is 349.0226 g/mol.
Where can I buy 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide?
You can request a quote for 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide?
Yes, CoreyChem provides custom synthesis services for 2-[(4-Fluorobenzoyl)amino]-1-isoindoliniminium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.