TL;DR: Pyridinone deriv. (CAS 143708-18-3) is a chemical compound with molecular formula C17H17N3O4 and molecular weight 327.12192 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 5-(1,3-benzoxazol-2-ylmethylamino)-2-methyl-6-oxo-1H-pyridine-3-carboxylate
Also Known As: Pyridinone deriv., 3-Aminopyridin-2(1H)-one analogue 69, ethyl 5-(1,3-benzoxazol-2-ylmethylamino)-2-methyl-6-oxo-1H-pyridine-3-carboxylate, 3-[(2-Benzoxazolylmethyl)amino]-6-methyl-5-(ethoxycarbonyl)pyridin-2(1H)-one, 5-[[(Benzoxazol-2-yl)methyl]amino]-1,6-dihydro-2-methyl-6-oxopyridine-3-carboxylic acid ethyl ester
| Molecular Formula | C17H17N3O4 |
| Molecular Weight | 327.12192 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 327.12192 Da |
| Heavy Atoms | 24 |
| Complexity | 584.0 |
| SMILES | CCOC(=O)C1=C(NC(=O)C(=C1)NCC2=NC3=CC=CC=C3O2)C |
| InChIKey | WPZAZROSBZXWGT-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridinone deriv.. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Pyridinone deriv.. Following Lipinski's Rule of Five, Pyridinone deriv. has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pyridinone deriv. is 143708-18-3.
The molecular formula of Pyridinone deriv. is C17H17N3O4.
The molecular weight of Pyridinone deriv. is 327.12192 g/mol.
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