4-bromo-N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)benzamide

Chemical Structure Depiction of
4-bromo-N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)benzamide
Available: 28 mg
Amount:
mg
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Compound characteristics

Compound ID: 8009-7966
Compound Name: 4-bromo-N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)benzamide
Molecular Weight: 432.34
Molecular Formula: C19 H18 Br N3 O2 S
Smiles: C1C2CN(CC1C1=CC=CC(N1C2)=O)C(NC(c1ccc(cc1)[Br])=O)=S
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.5925
logD: 3.5898
logSw: -3.7574
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 41.014
InChI Key: NHVZXZZUXMPHEW-UHFFFAOYSA-N
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