XR-334

AlkaPlorer ID: AK015614

Synonym: 'XR-334'

IUPAC Name: 3-benzylidene-6-[(4-methoxyphenyl)methylidene]piperazine-2,5-dione

Structure

SMILES: COC1=CC=C(C=C2N=C(O)C(=CC3=CC=CC=C3)NC2=O)C=C1

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InChI: InChI=1S/C19H16N2O3/c1-24-15-9-7-14(8-10-15)12-17-19(23)20-16(18(22)21-17)11-13-5-3-2-4-6-13/h2-12H,1H3,(H,20,23)(H,21,22)

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InChIKey: QMUALMJMQXNBIA-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 320.34800000000007

TPSA: 75.21000000000001

MolLogP: 1.1417

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information