5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione
TL;DR: 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione (CAS 84885-20-1) is a chemical compound with molecular formula C14H8BrNO3 and molecular weight 316.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione
Also Known As: 5-bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione, BAS 00119467, 5-bromo-2-(4-hydroxyphenyl)-1H-isoindole-1,3(2H)-dione, 5-Bromo-2-(4-hydroxy-phenyl)-isoindole-1,3-dione, 5-bromo-2-(4-hydroxyphenyl)isoindoline-1,3-dione
| Molecular Formula | C14H8BrNO3 |
|---|---|
| Molecular Weight | 316.97 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.96875 |
| Heavy Atoms | 19 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 84885-20-1 |
|---|---|
| SMILES | C1=CC(=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)Br)O |
| InChIKey | PISTWGFIBBAFDE-UHFFFAOYSA-N |
Product Overview
5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione (CAS 84885-20-1), with molecular formula C14H8BrNO3 and molecular weight 316.97 g/mol. IUPAC: 5-bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione.
Chemical Property Profile of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione
Property Insights of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione. With a topological polar surface area (TPSA) of 57.6 Ų, 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione 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 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione?
The CAS number of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione is 84885-20-1.
What is the molecular formula of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione?
The molecular formula of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione is C14H8BrNO3.
What is the molecular weight of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione?
The molecular weight of 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione is 316.97 g/mol.
Where can I buy 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione?
You can request a quote for 5-Bromo-2-(4-hydroxyphenyl)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-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-(4-hydroxyphenyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.