2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione
TL;DR: 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione (CAS 337474-19-8) is a chemical compound with molecular formula C15H9FN2O4 and molecular weight 300.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-fluorophenyl)methyl]-5-nitroisoindole-1,3-dione
Also Known As: 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione, UPCMLD0ENAT5722352:001, 2-[(4-fluorophenyl)methyl]-5-nitroisoindole-1,3-dione, J2.400.307H, 2-(4-fluorobenzyl)-5-nitro-1H-isoindole-1,3(2H)-dione
| Molecular Formula | C15H9FN2O4 |
|---|---|
| Molecular Weight | 300.05 g/mol |
| LogP | 2.5301 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.05463 |
| Heavy Atoms | 22 |
| Complexity | 801.68976 |
Chemical Identifiers
| CAS Number | 337474-19-8 |
|---|---|
| SMILES | C1=CC(=CC=C1CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])F |
Product Overview
2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione (CAS 337474-19-8), with molecular formula C15H9FN2O4 and molecular weight 300.05 g/mol. IUPAC: 2-[(4-fluorophenyl)methyl]-5-nitroisoindole-1,3-dione.
Chemical Property Profile of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione
Property Insights of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione
The XLogP value of 2.5301 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione. Following Lipinski's Rule of Five, 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione has 0 hydrogen bond donor(s) and 4 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 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione?
The CAS number of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione is 337474-19-8.
What is the molecular formula of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione?
The molecular formula of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione is C15H9FN2O4.
What is the molecular weight of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione?
The molecular weight of 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione is 300.05 g/mol.
Where can I buy 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione?
You can request a quote for 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorobenzyl)-5-nitroisoindoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.