6-(2H-1,3-benzodioxol-5-yl)-10-bromo-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Chemical Structure Depiction of
6-(2H-1,3-benzodioxol-5-yl)-10-bromo-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Available: 79 mg
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mg
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Compound characteristics

Compound ID: 4896-4205
Compound Name: 6-(2H-1,3-benzodioxol-5-yl)-10-bromo-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Molecular Weight: 473.35
Molecular Formula: C20 H17 Br N4 O3 S
Smiles: CCCSc1nc2c(c3cc(ccc3NC(c3ccc4c(c3)OCO4)O2)[Br])nn1
Stereo: RACEMIC MIXTURE
logP: 5.228
logD: 5.228
logSw: -5.1995
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 69.413
InChI Key: AFAAHEORNKNWBK-GOSISDBHSA-N
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