3-hydroxy-N-[2-[2-[(3-hydroxy-1-methyl-2-oxo-pyridine-4-carbonyl)amino]ethoxy]ethyl]-1-methyl-2-oxo-pyridine-4-carboxamide

HCID 391980

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Basic information

CAS: 165543-97-5
Standard SMILES: Cn1ccc(C(=O)NCCOCCNC(=O)c2ccn(C)c(=O)c2O)c(O)c1=O
InChIKey: UJBLQXIGCCWUTB-UHFFFAOYSA-N
Molecular formula: C18H22N4O7
Average molar mass: 406.4 g/mol
Monoisotopic mass: 406.14884905

Names & identifiers

Preferred name: 3-hydroxy-N-[2-[2-[(3-hydroxy-1-methyl-2-oxo-pyridine-4-carbonyl)amino]ethoxy]ethyl]-1-methyl-2-oxo-pyridine-4-carboxamide
IUPAC: 3-hydroxy-N-[2-[2-[(3-hydroxy-1-methyl-2-oxopyridine-4-carbonyl)amino]ethoxy]ethyl]-1-methyl-2-oxopyridine-4-carboxamide

Names & synonyms

NSC691702165543-97-5CHEMBL89831SCHEMBL21370828DTXSID103278315-LI-O-Me-3, 2-HOPO5-LIO (Me-3, 2-HOPO)NSC-6917023-hydroxy-N-[2-[2-[(3-hydroxy-1-methyl-2-oxo-pyridine-4-carbonyl)amino]ethoxy]ethyl]-1-methyl-2-oxo-pyridine-4-carboxamideNCI60_0329204-Pyridinecarboxamide,N'-(oxydi-2,1-ethanediyl)bis[1,2-dihydro-3-hydroxy-1-methyl-2-oxo-3-Hydroxy-N-(2-(2-(((3-hydroxy-1-methyl-2-oxo-1,2-dihydro-4-pyridinyl)carbonyl)amino)ethoxy)ethyl)-1-methyl-2-oxo-1,2-dihydro-4-pyridinecarboxamide

Show more names

N,N'-[Oxydi(ethane-2,1-diyl)]bis(3-hydroxy-1-methyl-2-oxo-1,2-dihydropyridine-4-carboxamide)

Database identifiers

CAS: 165543-97-5
PubChem CID: 391980
DTXSID: DTXSID10327831
ChEMBL: CHEMBL89831

Properties

Computed structural properties

XLogP: -0.8
Topological polar surface area: 149 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 7
Rotatable bonds: 8
Heavy atoms: 29
Formal charge: 0
Complexity: 773

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