TL;DR: N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine (CAS 112006-30-1) is a chemical compound with molecular formula C10H9N3O and molecular weight 187.07455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine
Also Known As: Maybridge3_000379, 1H-Imidazole-5-carboxaldehyde, 2-phenyl-, oxime
| Molecular Formula | C10H9N3O |
| Molecular Weight | 187.07455 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 61.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 187.07455 Da |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
| SMILES | C1=CC=C(C=C1)C2=NC=C(N2)C=NO |
| InChIKey | FZTHQGWRXISGFS-UHFFFAOYSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine. The TPSA of 61.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine. Following Lipinski's Rule of Five, N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine has 2 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 N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine is 112006-30-1.
The molecular formula of N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine is C10H9N3O.
The molecular weight of N-[(2-phenyl-1H-imidazol-5-yl)methylidene]hydroxylamine is 187.07455 g/mol.
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