3-Ethylidenehexahydropyrrolo[1,2-a]pyrazine-1,4-dione; (S)-form 

AlkaPlorer ID: AK298037

Synonym: None

IUPAC Name: (3E)-3-ethylidene-6,7,8,8a-tetrahydropyrrolo[1,2-a]pyrazine-1,4-dione

Structure

SMILES: C/C=C1/NC(=O)C2CCCN2C1=O

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InChI: InChI=1S/C9H12N2O2/c1-2-6-9(13)11-5-3-4-7(11)8(12)10-6/h2,7H,3-5H2,1H3,(H,10,12)/b6-2+

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InChIKey: ZNFUNIIHSUSXNE-QHHAFSJGSA-N

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Reference

PubChem CID: 131753031

CAS: 160706-82-1

Properties Information

Molecule Weight: 180.207

TPSA: 49.41

MolLogP: 0.0109999999999998

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information