2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine
TL;DR: 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine (CAS 876725-45-0) is a chemical compound with molecular formula C16H16N2O and molecular weight 252.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methoxy-5-methylphenyl)-3H-isoindol-1-imine
Also Known As: 2-(2-methoxy-5-methylphenyl)-1-isoindolinimine, 2-(2-methoxy-5-methylphenyl)-3H-isoindol-1-imine, AF-399/42920871, 2-(2-methoxy-5-methylphenyl)-2,3-dihydro-1H-isoindol-1-imine
| Molecular Formula | C16H16N2O |
|---|---|
| Molecular Weight | 252.13 g/mol |
| LogP | 3.34919 |
| Topological Polar Surface Area | 36.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.12627 |
| Heavy Atoms | 19 |
| Complexity | 648.9472 |
Chemical Identifiers
| CAS Number | 876725-45-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)N2CC3=CC=CC=C3C2=N |
Product Overview
2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine (CAS 876725-45-0), with molecular formula C16H16N2O and molecular weight 252.13 g/mol. IUPAC: 2-(2-methoxy-5-methylphenyl)-3H-isoindol-1-imine.
Chemical Property Profile of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine
Property Insights of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine
The XLogP value of 3.34919 indicates that 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.32 Ų, 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine 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 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine?
The CAS number of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine is 876725-45-0.
What is the molecular formula of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine?
The molecular formula of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine is C16H16N2O.
What is the molecular weight of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine?
The molecular weight of 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine is 252.13 g/mol.
Where can I buy 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine?
You can request a quote for 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Methoxy-5-methylphenyl)-1-isoindolinimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.