TL;DR: (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone (CAS 355815-15-5) is a chemical compound with molecular formula C18H18FN3O3 and molecular weight 343.1332 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone
Also Known As: 1-(4-fluorobenzoyl)-4-(2-nitrobenzyl)piperazine, AB00098566-01, (4-fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone, (4-fluorophenyl)[4-(2-nitrobenzyl)piperazin-1-yl]methanone, 1-(4-FLUOROBENZOYL)-4-[(2-NITROPHENYL)METHYL]PIPERAZINE
| Molecular Formula | C18H18FN3O3 |
| Molecular Weight | 343.1332 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 69.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 343.1332 Da |
| Heavy Atoms | 25 |
| Complexity | 469.0 |
| SMILES | C1CN(CCN1CC2=CC=CC=C2[N+](=O)[O-])C(=O)C3=CC=C(C=C3)F |
| InChIKey | NWVNYUARRFTBSN-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone. Following Lipinski's Rule of Five, (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone is 355815-15-5.
The molecular formula of (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone is C18H18FN3O3.
The molecular weight of (4-Fluorophenyl)-[4-[(2-nitrophenyl)methyl]piperazin-1-yl]methanone is 343.1332 g/mol.
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