TL;DR: 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)- (CAS 34442-94-9) is a chemical compound with molecular formula C14H8N2O4 and molecular weight 268.0484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-nitrophenyl)isoindole-1,3-dione
Also Known As: 2-(2-nitrophenyl)isoindole-1,3-dione, N-(2-Nitrophenyl)phthalimide, 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)-, 2-(2-Nitrophenyl)isoindoline-1,3-dione, N-(O-NITROPHENYL)PHTHALIMIDE
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H8N2O4 |
| Molecular Weight | 268.0484 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 83.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.0484 Da |
| Heavy Atoms | 20 |
| Complexity | 421.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC=C3[N+](=O)[O-] |
| InChIKey | FHPIULWDFMBJQJ-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)-. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)-. Following Lipinski's Rule of Five, 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)- 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 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)- is 34442-94-9.
The molecular formula of 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)- is C14H8N2O4.
The molecular weight of 1H-Isoindole-1,3(2H)-dione, 2-(2-nitrophenyl)- is 268.0484 g/mol.
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