2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one
TL;DR: 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one (CAS 512810-93-4) is a chemical compound with molecular formula C14H8Cl3NO and molecular weight 310.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one
Also Known As: 2-(2,4,5-trichlorophenyl)-1-isoindolinone, 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one, 2-(2,4,5-trichlorophenyl)isoindolin-1-one
| Molecular Formula | C14H8Cl3NO |
|---|---|
| Molecular Weight | 310.97 g/mol |
| LogP | 4.8072 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 310.96713 |
| Heavy Atoms | 19 |
| Complexity | 684.3865 |
Chemical Identifiers
| CAS Number | 512810-93-4 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)N1C3=CC(=C(C=C3Cl)Cl)Cl |
Product Overview
2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one (CAS 512810-93-4), with molecular formula C14H8Cl3NO and molecular weight 310.97 g/mol. IUPAC: 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one.
Chemical Property Profile of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one
Property Insights of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one
The XLogP value of 4.8072 indicates that 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one has 0 hydrogen bond donor(s) and 1 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-(2,4,5-trichlorophenyl)-3H-isoindol-1-one?
The CAS number of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one is 512810-93-4.
What is the molecular formula of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one?
The molecular formula of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one is C14H8Cl3NO.
What is the molecular weight of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one?
The molecular weight of 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one is 310.97 g/mol.
Where can I buy 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one?
You can request a quote for 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,4,5-trichlorophenyl)-3H-isoindol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.