3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione
TL;DR: 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione (CAS 497867-98-8) is a chemical compound with molecular formula C20H20N2O2 and molecular weight 320.15 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-(2-methylphenyl)pyrrolidine-2,5-dione
Also Known As: BAS 05289636, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione, 3-(3,4-Dihydro-1H-isoquinolin-2-yl)- 1-O-tolylpyrrolidine-2,5-dione, 3-(3,4-Dihydro-1H-isoquinolin-2-yl)-1-o-tolyl-pyrrolidine-2,5-dione, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(o-tolyl)pyrrolidine-2,5-dione
| Molecular Formula | C20H20N2O2 |
|---|---|
| Molecular Weight | 320.15 g/mol |
| LogP | 2.68522 |
| Topological Polar Surface Area | 40.62 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 320.15247 |
| Heavy Atoms | 24 |
| Complexity | 814.7911 |
Chemical Identifiers
| CAS Number | 497867-98-8 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=O)CC(C2=O)N3CCC4=CC=CC=C4C3 |
Product Overview
3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione (CAS 497867-98-8), with molecular formula C20H20N2O2 and molecular weight 320.15 g/mol. IUPAC: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione.
Chemical Property Profile of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione
Property Insights of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione
The XLogP value of 2.68522 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione. With a topological polar surface area (TPSA) of 40.62 Ų, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-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 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione?
The CAS number of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione is 497867-98-8.
What is the molecular formula of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione?
The molecular formula of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione is C20H20N2O2.
What is the molecular weight of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione?
The molecular weight of 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione is 320.15 g/mol.
Where can I buy 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione?
You can request a quote for 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione 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-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-dihydroisoquinolin-2(1H)-yl)-1-(2-methylphenyl)pyrrolidine-2,5-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.