1-[3-(butylsulfanyl)-8,10-dimethyl-6-phenyl[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one

Chemical Structure Depiction of
1-[3-(butylsulfanyl)-8,10-dimethyl-6-phenyl[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Available: 24 mg
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mg
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Compound characteristics

Compound ID: F579-1733
Compound Name: 1-[3-(butylsulfanyl)-8,10-dimethyl-6-phenyl[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Molecular Weight: 448.59
Molecular Formula: C25 H28 N4 O2 S
Smiles: CCCCSc1nc2c(c3cc(C)cc(C)c3N(C(c3ccccc3)O2)C(CC)=O)nn1
Stereo: RACEMIC MIXTURE
logP: 6.3991
logD: 6.3991
logSw: -5.5865
Hydrogen bond acceptors count: 7
Polar surface area: 54.801
InChI Key: UFLKSIKQPRBSRO-DEOSSOPVSA-N
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