TL;DR: 1-(3-Nitrophenyl)imidazolidin-2-one (CAS 109123-71-9) is a chemical compound with molecular formula C9H9N3O3 and molecular weight 207.06439 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-nitrophenyl)imidazolidin-2-one
Also Known As: 1-(3-nitrophenyl)imidazolidin-2-one, N-(3-nitrophenyl)-imidazolidinone, 1-(3-Nitro-phenyl)-imidazolidin-2-one, 2-imidazolidinone, 1-(3-nitrophenyl)-
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H9N3O3 |
| Molecular Weight | 207.06439 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 78.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.06439 Da |
| Heavy Atoms | 15 |
| Complexity | 276.0 |
| SMILES | C1CN(C(=O)N1)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | RTPRBBVFDDGLFS-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Nitrophenyl)imidazolidin-2-one. The TPSA of 78.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Nitrophenyl)imidazolidin-2-one. Following Lipinski's Rule of Five, 1-(3-Nitrophenyl)imidazolidin-2-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(3-Nitrophenyl)imidazolidin-2-one is 109123-71-9.
The molecular formula of 1-(3-Nitrophenyl)imidazolidin-2-one is C9H9N3O3.
The molecular weight of 1-(3-Nitrophenyl)imidazolidin-2-one is 207.06439 g/mol.
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