TL;DR: Iron(3+)-4-aminobenzohydroxamic acid complex (CAS 131612-27-6) is a chemical compound with molecular formula C21H21FeN6O6 and molecular weight 509.0872 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tris(4-amino-N-oxidobenzamide);iron(3+)
Also Known As: Fe(3+)-Abha, 4-amino-N-oxidobenzamide, Iron(3+)-4-aminobenzohydroxamic acid complex, 4-amino-N-oxidobenzamide; iron(3+), 4-amino-N-oxidobenzamide,iron(3+)
| Molecular Formula | C21H21FeN6O6 |
| Molecular Weight | 509.0872 g/mol |
| XLogP | 1.4867 |
| Topological Polar Surface Area (TPSA) | 235.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 509.0872 Da |
| Heavy Atoms | 34 |
| Complexity | 141.0 |
| SMILES | C1=CC(=CC=C1C(=O)N[O-])N.C1=CC(=CC=C1C(=O)N[O-])N.C1=CC(=CC=C1C(=O)N[O-])N.[Fe+3] |
| InChIKey | FEYJWNLLZVCLCI-UHFFFAOYSA-N |
The XLogP value of 1.4867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Iron(3+)-4-aminobenzohydroxamic acid complex. The TPSA of 235.0 Ų indicates high polarity, suggesting Iron(3+)-4-aminobenzohydroxamic acid complex may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Iron(3+)-4-aminobenzohydroxamic acid complex has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Iron(3+)-4-aminobenzohydroxamic acid complex is 131612-27-6.
The molecular formula of Iron(3+)-4-aminobenzohydroxamic acid complex is C21H21FeN6O6.
The molecular weight of Iron(3+)-4-aminobenzohydroxamic acid complex is 509.0872 g/mol.
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