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

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

Compound ID: F579-2203
Compound Name: 1-[3-(butylsulfanyl)-8,10-dimethyl-6-(pyridin-3-yl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethan-1-one
Molecular Weight: 435.55
Molecular Formula: C23 H25 N5 O2 S
Smiles: CCCCSc1nc2c(c3cc(C)cc(C)c3N(C(c3cccnc3)O2)C(C)=O)nn1
Stereo: RACEMIC MIXTURE
logP: 4.6437
logD: 4.6433
logSw: -4.3763
Hydrogen bond acceptors count: 8
Polar surface area: 65.314
InChI Key: UYUNHINIAGYGEE-QFIPXVFZSA-N
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