2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione
TL;DR: 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione (CAS 76995-57-8) is a chemical compound with molecular formula C20H17NO3 and molecular weight 319.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione
Also Known As: 2-(4-phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione, 2-(4-phenoxyphenyl)-4,5,6,7-tetrahydro-1h-isoindole-1,3(2h)-dione
| Molecular Formula | C20H17NO3 |
|---|---|
| Molecular Weight | 319.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.12085 |
| Heavy Atoms | 24 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 76995-57-8 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4 |
| InChIKey | ZPXWVNNYJDDPSB-UHFFFAOYSA-N |
Product Overview
2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione (CAS 76995-57-8), with molecular formula C20H17NO3 and molecular weight 319.12 g/mol. IUPAC: 2-(4-phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione.
Chemical Property Profile of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione
Property Insights of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione
The XLogP value of 4.0 indicates that 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.6 Ų, 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione 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-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione?
The CAS number of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione is 76995-57-8.
What is the molecular formula of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione?
The molecular formula of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione is C20H17NO3.
What is the molecular weight of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione?
The molecular weight of 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione is 319.12 g/mol.
Where can I buy 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione?
You can request a quote for 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-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-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Phenoxyphenyl)-4,5,6,7-tetrahydroisoindole-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.