TL;DR: N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide (CAS 1446814-24-9) is a chemical compound with molecular formula C10H8ClN3O and molecular weight 221.03558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E)-(2-chlorophenyl)methylideneamino]-2-cyanoacetamide
Also Known As: BAS 01048946, N'-(2-chlorobenzylidene)-2-cyanoacetohydrazide, N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide, Cyano-acetic acid (2-chloro-benzylidene)-hydrazide, (E)-N'-(2-chlorobenzylidene)-2-cyanoacetohydrazide
| Molecular Formula | C10H8ClN3O |
| Molecular Weight | 221.03558 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 65.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.03558 Da |
| Heavy Atoms | 15 |
| Complexity | 294.0 |
| SMILES | C1=CC=C(C(=C1)/C=N/NC(=O)CC#N)Cl |
| InChIKey | XDSPOYNCHBFWFL-NTUHNPAUSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide. The TPSA of 65.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide. Following Lipinski's Rule of Five, N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide has 1 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'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide is 1446814-24-9.
The molecular formula of N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide is C10H8ClN3O.
The molecular weight of N'-[(E)-(2-chlorophenyl)methylidene]-2-cyanoacetohydrazide is 221.03558 g/mol.
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