2-(3,4-Dimethoxyphenyl)isoindolin-1-one
TL;DR: 2-(3,4-Dimethoxyphenyl)isoindolin-1-one (CAS 89313-73-5) is a chemical compound with molecular formula C16H15NO3 and molecular weight 269.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-3H-isoindol-1-one
Also Known As: 2-(3,4-DIMETHOXYPHENYL)ISOINDOLIN-1-ONE, UVXYBRHCULJHEP-UHFFFAOYSA, 2-(3,4-dimethoxyphenyl)-3H-isoindol-1-one, 2-(3,4-Dimethoxyphenyl)isoindoline-1-one, J3.036.880K
| Molecular Formula | C16H15NO3 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 2.8642 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.1052 |
| Heavy Atoms | 20 |
| Complexity | 666.5216 |
Chemical Identifiers
| CAS Number | 89313-73-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)N2CC3=CC=CC=C3C2=O)OC |
Product Overview
2-(3,4-Dimethoxyphenyl)isoindolin-1-one (CAS 89313-73-5), with molecular formula C16H15NO3 and molecular weight 269.11 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-3H-isoindol-1-one.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one
Property Insights of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one
The XLogP value of 2.8642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethoxyphenyl)isoindolin-1-one. With a topological polar surface area (TPSA) of 38.77 Ų, 2-(3,4-Dimethoxyphenyl)isoindolin-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)isoindolin-1-one has 0 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 2-(3,4-Dimethoxyphenyl)isoindolin-1-one?
The CAS number of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one is 89313-73-5.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one?
The molecular formula of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one is C16H15NO3.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one?
The molecular weight of 2-(3,4-Dimethoxyphenyl)isoindolin-1-one is 269.11 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)isoindolin-1-one?
You can request a quote for 2-(3,4-Dimethoxyphenyl)isoindolin-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-(3,4-Dimethoxyphenyl)isoindolin-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)isoindolin-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.