TL;DR: 4-(4-Nitrophenoxy)benzamide (CAS 106163-96-6) is a chemical compound with molecular formula C13H10N2O4 and molecular weight 258.06406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(4-nitrophenoxy)benzamide
Also Known As: 4-(4-nitrophenoxy)benzamide, 4-{4-nitrophenoxy}benzamide, BIM-0022200.P001, AE-473/31198060, Cambridge id 5486325
| Molecular Formula | C13H10N2O4 |
| Molecular Weight | 258.06406 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 98.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.06406 Da |
| Heavy Atoms | 19 |
| Complexity | 326.0 |
| SMILES | C1=CC(=CC=C1C(=O)N)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | MTHPAXCNLKLPNT-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Nitrophenoxy)benzamide. The TPSA of 98.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Nitrophenoxy)benzamide. Following Lipinski's Rule of Five, 4-(4-Nitrophenoxy)benzamide has 1 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 4-(4-Nitrophenoxy)benzamide is 106163-96-6.
The molecular formula of 4-(4-Nitrophenoxy)benzamide is C13H10N2O4.
The molecular weight of 4-(4-Nitrophenoxy)benzamide is 258.06406 g/mol.
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