TL;DR: Nialamide HCl (CAS 1161-03-1) is a chemical compound with molecular formula C16H19ClN4O2 and molecular weight 334.11966 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-[3-[2-(pyridine-4-carbonyl)hydrazinyl]propanoyl]azanium chloride
Also Known As: Nialamide HCl, Nialamide monohydrochloride, ISONICOTINIC ACID, 2-(2-(BENZYLCARBAMOYL)ETHYL)HYDRAZIDE, HYDROCHLORIDE, benzyl-[3-[2-(pyridine-4-carbonyl)hydrazinyl]propanoyl]azanium chloride, 4-Pyridinecarboxylic acid, 2-(3-oxo-3-((phenylmethyl)amino)propyl)hydrazide, hydrochloride (1:1)
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H19ClN4O2 |
| Molecular Weight | 334.11966 g/mol |
| XLogP | -3.0 |
| Topological Polar Surface Area (TPSA) | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 334.11966 Da |
| Heavy Atoms | 23 |
| Complexity | 350.0 |
| SMILES | C1=CC=C(C=C1)C[NH2+]C(=O)CCNNC(=O)C2=CC=NC=C2.[Cl-] |
| InChIKey | XPLZAZCGEUUFJL-UHFFFAOYSA-N |
The XLogP value of -3.0 indicates that Nialamide HCl is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Nialamide HCl. Following Lipinski's Rule of Five, Nialamide HCl has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Nialamide HCl is 1161-03-1.
The molecular formula of Nialamide HCl is C16H19ClN4O2.
The molecular weight of Nialamide HCl is 334.11966 g/mol.
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