5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione
TL;DR: 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione (CAS 351979-83-4) is a chemical compound with molecular formula C23H13BrN2O4 and molecular weight 460.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione
Also Known As: AB00096447-01, 5-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione, 5-(6-bromo-4-oxo-4H-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)-1H-isoindole-1,3(2H)-dione, 5-(6-BROMO-4-OXO-4H-3,1-BENZOXAZIN-2-YL)-2-(2-METHYLPHENYL)-2,3-DIHYDRO-1H-ISOINDOLE-1,3-DIONE
| Molecular Formula | C23H13BrN2O4 |
|---|---|
| Molecular Weight | 460.01 g/mol |
| LogP | 4.72652 |
| Topological Polar Surface Area | 80.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 460.00586 |
| Heavy Atoms | 30 |
| Complexity | 1441.0902 |
Chemical Identifiers
| CAS Number | 351979-83-4 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(C=C(C=C5)Br)C(=O)O4 |
Product Overview
5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione (CAS 351979-83-4), with molecular formula C23H13BrN2O4 and molecular weight 460.01 g/mol. IUPAC: 5-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione.
Chemical Property Profile of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione
Property Insights of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione
The XLogP value of 4.72652 indicates that 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione. Following Lipinski's Rule of Five, 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione has 0 hydrogen bond donor(s) and 5 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 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione?
The CAS number of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione is 351979-83-4.
What is the molecular formula of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione?
The molecular formula of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione is C23H13BrN2O4.
What is the molecular weight of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione?
The molecular weight of 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione is 460.01 g/mol.
Where can I buy 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione?
You can request a quote for 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-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 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(6-Bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-methylphenyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.