2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione
TL;DR: 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione (CAS 634166-30-6) is a chemical compound with molecular formula C17H15NO3 and molecular weight 281.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenoxyethyl)-4H-isoquinoline-1,3-dione
Also Known As: 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione, 2-(2-phenoxyethyl)-4H-isoquinoline-1,3-dione, 1,3(2H,4H)-isoquinolinedione, 2-(2-phenoxyethyl)-, 2-(2-phenoxyethyl)-1,2,3,4-tetrahydroisoquinoline-1,3-dione, 2-(2-phenoxyethyl)-2,4-dihydroisoquinoline-1,3-dione
| Molecular Formula | C17H15NO3 |
|---|---|
| Molecular Weight | 281.11 g/mol |
| LogP | 2.2905 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.1052 |
| Heavy Atoms | 21 |
| Complexity | 666.74524 |
Chemical Identifiers
| CAS Number | 634166-30-6 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)N(C1=O)CCOC3=CC=CC=C3 |
Product Overview
2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione (CAS 634166-30-6), with molecular formula C17H15NO3 and molecular weight 281.11 g/mol. IUPAC: 2-(2-phenoxyethyl)-4H-isoquinoline-1,3-dione.
Chemical Property Profile of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione
Property Insights of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione
The XLogP value of 2.2905 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione. With a topological polar surface area (TPSA) of 46.61 Ų, 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-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-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione?
The CAS number of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione is 634166-30-6.
What is the molecular formula of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione?
The molecular formula of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione is C17H15NO3.
What is the molecular weight of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione?
The molecular weight of 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione is 281.11 g/mol.
Where can I buy 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione?
You can request a quote for 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-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-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-phenoxyethyl)isoquinoline-1,3(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.