2-(3-phenylprop-2-ynyl)isoindole-1,3-dione
TL;DR: 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione (CAS 4656-94-4) is a chemical compound with molecular formula C17H11NO2 and molecular weight 261.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-phenylprop-2-ynyl)isoindole-1,3-dione
Also Known As: 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione, N-(3-phenyl-2-propynyl)-phthalimide, 2-(3-phenyl-2-propynyl)-1H-isoindole-1,3(2H)-dione, 2-(3-Phenylpropargyl)isoindoline-1,3-dione, J2.404.930B
| Molecular Formula | C17H11NO2 |
|---|---|
| Molecular Weight | 261.08 g/mol |
| LogP | 2.3343 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 261.07898 |
| Heavy Atoms | 20 |
| Complexity | 703.3305 |
Chemical Identifiers
| CAS Number | 4656-94-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CCN2C(=O)C3=CC=CC=C3C2=O |
Product Overview
2-(3-phenylprop-2-ynyl)isoindole-1,3-dione (CAS 4656-94-4), with molecular formula C17H11NO2 and molecular weight 261.08 g/mol. IUPAC: 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione.
Chemical Property Profile of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione
Property Insights of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione
The XLogP value of 2.3343 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione. With a topological polar surface area (TPSA) of 37.38 Ų, 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione has 0 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-(3-phenylprop-2-ynyl)isoindole-1,3-dione?
The CAS number of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione is 4656-94-4.
What is the molecular formula of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione?
The molecular formula of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione is C17H11NO2.
What is the molecular weight of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione?
The molecular weight of 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione is 261.08 g/mol.
Where can I buy 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione?
You can request a quote for 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-phenylprop-2-ynyl)isoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.