TL;DR: Niacinamide salicylate (CAS 66634-12-6) is a chemical compound with molecular formula C13H12N2O4 and molecular weight 260.0797 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxybenzoic acid;pyridine-3-carboxamide
Also Known As: Niksalin, Niksalin [German], Niacinamide salicylate, Nicotinamide salicylate, Nicotinamid-salicylat
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H12N2O4 |
| Molecular Weight | 260.0797 g/mol |
| XLogP | 1.27 |
| Topological Polar Surface Area (TPSA) | 114.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.0797 Da |
| Heavy Atoms | 19 |
| Complexity | 246.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)O)O.C1=CC(=CN=C1)C(=O)N |
| InChIKey | HXLQIJRKKFMNGU-UHFFFAOYSA-N |
The XLogP value of 1.27 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Niacinamide salicylate. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Niacinamide salicylate. Following Lipinski's Rule of Five, Niacinamide salicylate 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 Niacinamide salicylate is 66634-12-6.
The molecular formula of Niacinamide salicylate is C13H12N2O4.
The molecular weight of Niacinamide salicylate is 260.0797 g/mol.
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