3-(butylsulfanyl)-6-[4-(propan-2-yl)phenyl]-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine

Chemical Structure Depiction of
3-(butylsulfanyl)-6-[4-(propan-2-yl)phenyl]-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Available: 104 mg
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mg
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Compound characteristics

Compound ID: 2049-1794
Compound Name: 3-(butylsulfanyl)-6-[4-(propan-2-yl)phenyl]-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Molecular Weight: 406.55
Molecular Formula: C23 H26 N4 O S
Smiles: CCCCSc1nc2c(c3ccccc3NC(c3ccc(cc3)C(C)C)O2)nn1
Stereo: RACEMIC MIXTURE
logP: 6.385
logD: 6.385
logSw: -5.7183
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 52.297
InChI Key: CRHHECFUWOYVCK-NRFANRHFSA-N
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