3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione
TL;DR: 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione (CAS 354789-28-9) is a chemical compound with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione
Also Known As: 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione, AN-919/14384240, 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione, 1-(4-ETHOXYPHENYL)-3-(1,2,3,4-TETRAHYDROISOQUINOLIN-2-YL)PYRROLIDINE-2,5-DIONE
| Molecular Formula | C21H22N2O3 |
|---|---|
| Molecular Weight | 350.16 g/mol |
| LogP | 2.7755 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.16306 |
| Heavy Atoms | 26 |
| Complexity | 831.4048 |
Chemical Identifiers
| CAS Number | 354789-28-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(=O)CC(C2=O)N3CCC4=CC=CC=C4C3 |
Product Overview
3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione (CAS 354789-28-9), with molecular formula C21H22N2O3 and molecular weight 350.16 g/mol. IUPAC: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-ethoxyphenyl)pyrrolidine-2,5-dione.
Chemical Property Profile of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione
Property Insights of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione
The XLogP value of 2.7755 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione. With a topological polar surface area (TPSA) of 49.85 Ų, 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione 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 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione?
The CAS number of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione is 354789-28-9.
What is the molecular formula of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione?
The molecular formula of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione is C21H22N2O3.
What is the molecular weight of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione?
The molecular weight of 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione is 350.16 g/mol.
Where can I buy 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione?
You can request a quote for 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dihydro-2(1H)-isoquinolinyl)-1-(4-ethoxyphenyl)-2,5-pyrrolidinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.