3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione structure

3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione

TL;DR: 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione (CAS 299404-97-0) is a chemical compound with molecular formula C31H20ClNO2 and molecular weight 473.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

3-(4-chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione

Also Known As: BAS 00802172, 3-(4-chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione, 1-(4-Chloro-phenyl)-3-phenyl-2-p-tolyl-2H-benzo[f]isoindole-4,9-dione, 1-(4-chlorophenyl)-3-phenyl-2-(p-tolyl)-2H-benzo[f]isoindole-4,9-dione, 1-(4-chlorophenyl)-2-(4-methylphenyl)-3-phenyl-2H-benzo[f]isoindole-4,9-dione

CAS: 299404-97-0
Molecular Formula C31H20ClNO2
Molecular Weight 473.12 g/mol
LogP 7.54852
Topological Polar Surface Area 39.07 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 2
Rotatable Bonds 3
Exact Mass 473.11826
Heavy Atoms 35
Complexity 1611.9272

Chemical Identifiers

CAS Number 299404-97-0
SMILES CC1=CC=C(C=C1)N2C(=C3C(=C2C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5C3=O)C6=CC=CC=C6

Product Overview

3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione (CAS 299404-97-0), with molecular formula C31H20ClNO2 and molecular weight 473.12 g/mol. IUPAC: 3-(4-chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione

XLogP
7.54852
TPSA (Topological Polar Surface Area)
39.07
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
3
Heavy Atoms
35
Complexity
1611.9272
Exact Mass
473.11826
Monoisotopic Mass
473.11826
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione

The XLogP value of 7.54852 indicates that 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.07 Ų, 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione?

The CAS number of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione is 299404-97-0.

What is the molecular formula of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione?

The molecular formula of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione is C31H20ClNO2.

What is the molecular weight of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione?

The molecular weight of 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione is 473.12 g/mol.

Where can I buy 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione?

You can request a quote for 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione?

Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-2-(4-methylphenyl)-1-phenylbenzo[f]isoindole-4,9-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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