3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one
TL;DR: 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one (CAS 40061-88-9) is a chemical compound with molecular formula C21H17NO2 and molecular weight 315.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one
Also Known As: 2,5-Pyrrolidinedione,3-hydroxy-3-phenyl, 3-hydroxy-3-phenyl-pyrrolidine-2,5-dione, 3-hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one, 3-hydroxy-2-(3-methylphenyl)-3-phenyl-2,3-dihydro-1h-isoindol-1-one, 1H-Isoindol-1-one,2,3-dihydro-3-hydroxy-2-(3-methylphenyl)-3-phenyl-
| Molecular Formula | C21H17NO2 |
|---|---|
| Molecular Weight | 315.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.12592 |
| Heavy Atoms | 24 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 40061-88-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=CC=CC=C3C2(C4=CC=CC=C4)O |
| InChIKey | XVQCPZPTOSYJBP-UHFFFAOYSA-N |
Product Overview
3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one (CAS 40061-88-9), with molecular formula C21H17NO2 and molecular weight 315.13 g/mol. IUPAC: 3-hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one.
Chemical Property Profile of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one
Property Insights of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one
The XLogP value of 3.8 indicates that 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one has 1 hydrogen bond donor(s) and 2 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 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one?
The CAS number of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one is 40061-88-9.
What is the molecular formula of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one?
The molecular formula of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one is C21H17NO2.
What is the molecular weight of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one?
The molecular weight of 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one is 315.13 g/mol.
Where can I buy 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one?
You can request a quote for 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-2-(3-methylphenyl)-3-phenylisoindol-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.