7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione
TL;DR: 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione (CAS 73109-32-7) 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.
7-methoxy-2-(4-methylphenyl)-4H-isoquinoline-1,3-dione
Also Known As: 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione, 7-methoxy-2-(4-methylphenyl)-4H-isoquinoline-1,3-dione, 7-Methoxy-2-(4-methylphenyl)isoquinoline-1,3(2H,4H)-dione, 7-methoxy-2-(4-methylphenyl)-2,4-dihydroisoquinoline-1,3-dione
| Molecular Formula | C17H15NO3 |
|---|---|
| Molecular Weight | 281.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 281.1052 |
| Heavy Atoms | 21 |
| Complexity | 414.0 |
Chemical Identifiers
| CAS Number | 73109-32-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)CC3=C(C2=O)C=C(C=C3)OC |
| InChIKey | QOFCWXZJKNLFGI-UHFFFAOYSA-N |
Product Overview
7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione (CAS 73109-32-7), with molecular formula C17H15NO3 and molecular weight 281.11 g/mol. IUPAC: 7-methoxy-2-(4-methylphenyl)-4H-isoquinoline-1,3-dione.
Chemical Property Profile of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione
Property Insights of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione. With a topological polar surface area (TPSA) of 46.6 Ų, 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione 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 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione?
The CAS number of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione is 73109-32-7.
What is the molecular formula of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione?
The molecular formula of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione is C17H15NO3.
What is the molecular weight of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione?
The molecular weight of 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione is 281.11 g/mol.
Where can I buy 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione?
You can request a quote for 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione?
Yes, KEHONG BIO provides custom synthesis services for 7-Methoxy-2-(4-methylphenyl)-1,3(2H,4H)-isoquinolinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.