6-(2-chloro-6-fluorophenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Chemical Structure Depiction of
6-(2-chloro-6-fluorophenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
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Compound characteristics

Compound ID: 4896-2253
Compound Name: 6-(2-chloro-6-fluorophenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Molecular Weight: 374.82
Molecular Formula: C17 H12 Cl F N4 O S
Smiles: CSc1nc2c(c3ccccc3NC(c3c(cccc3[Cl])F)O2)nn1
Stereo: RACEMIC MIXTURE
logP: 3.9761
logD: 3.9761
logSw: -4.3983
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 52.297
InChI Key: SLQWJXBZEOVCQM-HNNXBMFYSA-N
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