2-(3,4-dimethoxyphenyl)-N-[[4-[[[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]methyl]phenyl]methyl]quinoline-4-carboxamide

HCID 5201286

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Basic information

CAS: 6371-05-7
Standard SMILES: COc1ccc(-c2cc(C(=O)NCc3ccc(CNC(=O)c4cc(-c5ccc(OC)c(OC)c5)nc5ccccc45)cc3)c3ccccc3n2)cc1OC
InChIKey: IZCKRJCNEOBUGV-UHFFFAOYSA-N
Molecular formula: C44H38N4O6
Average molar mass: 718.8 g/mol
Monoisotopic mass: 718.27913494

Names & identifiers

Preferred name: 2-(3,4-dimethoxyphenyl)-N-[[4-[[[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]methyl]phenyl]methyl]quinoline-4-carboxamide
IUPAC: 2-(3,4-dimethoxyphenyl)-N-[[4-[[[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]methyl]phenyl]methyl]quinoline-4-carboxamide

Names & synonyms

6371-05-72-(3,4-dimethoxyphenyl)-N-[[4-[[[2-(3,4-dimethoxyphenyl)quinoline-4-carbonyl]amino]methyl]phenyl]methyl]quinoline-4-carboxamideDTXSID50409529AKOS003876255N,N'-[1,4-Phenylenebis(methylene)]bis[2-(3,4-dimethoxyphenyl)quinoline-4-carboxamide]

Database identifiers

CAS: 6371-05-7
PubChem CID: 5201286
DTXSID: DTXSID50409529

Properties

Computed structural properties

XLogP: 7.2
Topological polar surface area: 121 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 8
Rotatable bonds: 12
Heavy atoms: 54
Formal charge: 0
Complexity: 1,110

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