2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
TL;DR: 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione (CAS 20707-41-9) is a chemical compound with molecular formula C16H17NO4 and molecular weight 287.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethoxyphenyl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
Also Known As: 2-(2-ethoxyphenyl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione, exo-cis-N-(2-Ethoxyphenyl)-7-oxabicyclo(2.2.1)heptane-2,3-dicarboximide, 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboximide, N-(2-ethoxyphenyl)-, exo-(Z)-, RefChem:1060862
| Molecular Formula | C16H17NO4 |
|---|---|
| Molecular Weight | 287.12 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.11575 |
| Heavy Atoms | 21 |
| Complexity | 437.0 |
Chemical Identifiers
| CAS Number | 20707-41-9 |
|---|---|
| SMILES | CCOC1=CC=CC=C1N2C(=O)C3C4CCC(C3C2=O)O4 |
| InChIKey | QKLVXOYMOLDCNG-UHFFFAOYSA-N |
Product Overview
2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione (CAS 20707-41-9), with molecular formula C16H17NO4 and molecular weight 287.12 g/mol. IUPAC: 2-(2-ethoxyphenyl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione.
Chemical Property Profile of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Property Insights of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 55.8 Ų, 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 4 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-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
The CAS number of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione is 20707-41-9.
What is the molecular formula of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
The molecular formula of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione is C16H17NO4.
What is the molecular weight of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
The molecular weight of 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione is 287.12 g/mol.
Where can I buy 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
You can request a quote for 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Ethoxyphenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.