(2,5-dimethylfuran-3-yl)[rel-(6R,9S)-3-methyl-5,6,7,8,9,10-hexahydro-6,9-epimino[1,2,4]triazolo[4,3-a]azocin-11-yl]methanone

Chemical Structure Depiction of
(2,5-dimethylfuran-3-yl)[rel-(6R,9S)-3-methyl-5,6,7,8,9,10-hexahydro-6,9-epimino[1,2,4]triazolo[4,3-a]azocin-11-yl]methanone
Available: 16 mg
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mg
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Compound characteristics

Compound ID: SA12-0008
Compound Name: (2,5-dimethylfuran-3-yl)[rel-(6R,9S)-3-methyl-5,6,7,8,9,10-hexahydro-6,9-epimino[1,2,4]triazolo[4,3-a]azocin-11-yl]methanone
Molecular Weight: 300.36
Molecular Formula: C16 H20 N4 O2
Smiles: Cc1nnc2C[C@@H]3CC[C@H](Cn12)N3C(c1cc(C)oc1C)=O
Stereo: RACEMIC MIXTURE (RELATIVE)
logP: 0.1585
logD: 0.1584
logSw: -1.3806
Hydrogen bond acceptors count: 5
Polar surface area: 49.32
InChI Key: UCKPERSJPRGAJY-UHFFFAOYSA-N
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