TL;DR: 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione (CAS 138806-07-2) is a chemical compound with molecular formula C23H20N2O3 and molecular weight 372.1474 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione
Also Known As: BIM-0022945.P001, 2-(3-methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione, 2-(3-methylphenyl)-6-(morpholin-4-yl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, 6-morpholino-2-(m-tolyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione, 2-(3-METHYLPHENYL)-6-MORPHOLINO-1H-BENZO[DE]ISOQUINOLINE-1,3(2H)-DIONE
| Molecular Formula | C23H20N2O3 |
| Molecular Weight | 372.1474 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 372.1474 Da |
| Heavy Atoms | 28 |
| Complexity | 617.0 |
| SMILES | CC1=CC(=CC=C1)N2C(=O)C3=C4C(=C(C=C3)N5CCOCC5)C=CC=C4C2=O |
| InChIKey | WNVXWOJVNYSKNJ-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.9 Ų, 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione is 138806-07-2.
The molecular formula of 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione is C23H20N2O3.
The molecular weight of 2-(3-Methylphenyl)-6-morpholin-4-ylbenzo[de]isoquinoline-1,3-dione is 372.1474 g/mol.
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