(6S)-6-[2-(3-methylimidazol-4-yl)-2-oxoethyl]-1,3,4,6-tetrahydro-1-benzazocine-2,5-dione

AlkaPlorer ID: AK224741

Synonym: None

IUPAC Name: (6S)-6-[2-(3-methylimidazol-4-yl)-2-oxoethyl]-1,3,4,6-tetrahydro-1-benzazocine-2,5-dione

Structure

SMILES: CN1C=NC=C1C(=O)C[C@@H]1C(=O)CCC(O)=NC2=CC=CC=C21

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InChI: InChI=1S/C17H17N3O3/c1-20-10-18-9-14(20)16(22)8-12-11-4-2-3-5-13(11)19-17(23)7-6-15(12)21/h2-5,9-10,12H,6-8H2,1H3,(H,19,23)/t12-/m0/s1

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InChIKey: NJTOLJLBZQDUHY-LBPRGKRZSA-N

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Properties Information

Molecule Weight: 311.341

TPSA: 84.55

MolLogP: 2.7276000000000007

Number of H-Donors: 1

Number of H-Acceptors: 5

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information