3-(methylsulfanyl)-6-(1-phenylprop-1-en-2-yl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Chemical Structure Depiction of
3-(methylsulfanyl)-6-(1-phenylprop-1-en-2-yl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Available: 33 mg
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mg
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Compound characteristics

Compound ID: 4896-0175
Compound Name: 3-(methylsulfanyl)-6-(1-phenylprop-1-en-2-yl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Molecular Weight: 362.45
Molecular Formula: C20 H18 N4 O S
Smiles: C/C(=C\c1ccccc1)C1Nc2ccccc2c2c(nc(nn2)SC)O1
Stereo: RACEMIC MIXTURE
logP: 4.645
logD: 4.645
logSw: -4.5845
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 52.297
InChI Key: HXXAYZRSGASZRN-SFHVURJKSA-N
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