1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one

Chemical Structure Depiction of
1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one
Available: 22 mg
Amount:
mg
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Compound characteristics

Compound ID: 8017-1965
Compound Name: 1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(5-propyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]ethan-1-one
Molecular Weight: 504.7
Molecular Formula: C28 H36 N6 O S
Smiles: CCCn1c2ccccc2c2c1nc(nn2)SCC(N1CCN(CC1)C12CC3CC(CC(C3)C2)C1)=O
Stereo: ACHIRAL
logP: 5.3238
logD: 5.298
logSw: -5.5872
Hydrogen bond acceptors count: 7
Polar surface area: 52.301
InChI Key: QFAVLZIICFFIJZ-UHFFFAOYSA-N
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