5-{[5-(4-methoxyphenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

AlkaPlorer ID: AK201558

Synonym: None

IUPAC Name: 5-[[5-(4-methoxyphenyl)furan-2-yl]methylidene]-2,6-dioxopyrimidin-4-olate

Structure

SMILES: COC1=CC=C(C2=CC=C(C=C3C([O-])=NC(=O)N=C3O)O2)C=C1

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InChI: InChI=1S/C16H12N2O5/c1-22-10-4-2-9(3-5-10)13-7-6-11(23-13)8-12-14(19)17-16(21)18-15(12)20/h2-8H,1H3,(H2,17,18,19,20,21)/p-1

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InChIKey: UOURPSZIXKPGMH-UHFFFAOYSA-M

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Reference

NPASS: NPC204998

COCONUT: CNP0088485

Source

Properties Information

Molecule Weight: 311.273

TPSA: 107.45

MolLogP: 2.1875

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information