TL;DR: Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)- (CAS 133661-80-0) is a chemical compound with molecular formula C9H8ClN3O2 and molecular weight 225.0305 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-[(E)-(2-chlorophenyl)methylideneamino]oxamide
Also Known As: N'-[(E)-(2-chlorophenyl)methylideneamino]oxamide, (E)-Aminooxoacetic acid ((2-chlorophenyl)methylene)hydrazide, Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)-, N-[(1E)-2-(2-chlorophenyl)-1-azavinyl]carbamoylcarboxamide, BRN 4252582
| Molecular Formula | C9H8ClN3O2 |
| Molecular Weight | 225.0305 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 84.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.0305 Da |
| Heavy Atoms | 15 |
| Complexity | 281.0 |
| SMILES | C1=CC=C(C(=C1)/C=N/NC(=O)C(=O)N)Cl |
| InChIKey | DLCJTCFPYCRHFP-LFYBBSHMSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)-. The TPSA of 84.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)-. Following Lipinski's Rule of Five, Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)- 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 Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)- is 133661-80-0.
The molecular formula of Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)- is C9H8ClN3O2.
The molecular weight of Acetic acid, aminooxo-, ((2-chlorophenyl)methylene)hydrazide, (E)- is 225.0305 g/mol.
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