4,4-Dimethyl-2-phenylisoquinoline-1,3-dione
TL;DR: 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione (CAS 326918-01-8) is a chemical compound with molecular formula C17H15NO2 and molecular weight 265.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-2-phenylisoquinoline-1,3-dione
Also Known As: 4,4-dimethyl-2-phenylisoquinoline-1,3-dione, 4,4-dimethyl-2-phenylisoquinoline-1,3(2H,4H)-dione, 4,4-Dimethyl-2-phenyl-4H-isochinolin-1,3-dion, 4,4-dimethyl-2-phenyl-1,2,3,4-tetrahydroisoquinoline-1,3-dione, 4,4-dimethyl-2-phenyl-1,3(2H,4H)-isoquinolinedione
| Molecular Formula | C17H15NO2 |
|---|---|
| Molecular Weight | 265.11 g/mol |
| LogP | 3.1512 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 265.1103 |
| Heavy Atoms | 20 |
| Complexity | 689.146 |
Chemical Identifiers
| CAS Number | 326918-01-8 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(=O)N(C1=O)C3=CC=CC=C3)C |
Product Overview
4,4-Dimethyl-2-phenylisoquinoline-1,3-dione (CAS 326918-01-8), with molecular formula C17H15NO2 and molecular weight 265.11 g/mol. IUPAC: 4,4-dimethyl-2-phenylisoquinoline-1,3-dione.
Chemical Property Profile of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione
Property Insights of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione
The XLogP value of 3.1512 indicates that 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.38 Ų, 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione has 0 hydrogen bond donor(s) and 2 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 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione?
The CAS number of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione is 326918-01-8.
What is the molecular formula of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione?
The molecular formula of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione is C17H15NO2.
What is the molecular weight of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione?
The molecular weight of 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione is 265.11 g/mol.
Where can I buy 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione?
You can request a quote for 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-2-phenylisoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.