TL;DR: 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione (CAS 139542-77-1) is a chemical compound with molecular formula C20H15NO2 and molecular weight 301.1103 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2,4-dimethylphenyl)benzo[de]isoquinoline-1,3-dione
Also Known As: 2-(2,4-dimethylphenyl)benzo[de]isoquinoline-1,3-dione, 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
| Molecular Formula | C20H15NO2 |
| Molecular Weight | 301.1103 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 301.1103 Da |
| Heavy Atoms | 23 |
| Complexity | 472.0 |
| SMILES | CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C |
| InChIKey | GGLVTLJDBMEKMD-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione is 139542-77-1.
The molecular formula of 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione is C20H15NO2.
The molecular weight of 2-(2,4-dimethylphenyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione is 301.1103 g/mol.
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