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

Chemical Structure Depiction of
10-bromo-6-(5-methylthiophen-2-yl)-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Available: 109 mg
Amount:
mg
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Compound characteristics

Compound ID: 6848-0385
Compound Name: 10-bromo-6-(5-methylthiophen-2-yl)-3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Molecular Weight: 477.44
Molecular Formula: C20 H21 Br N4 O S2
Smiles: CCCCCSc1nc2c(c3cc(ccc3NC(c3ccc(C)s3)O2)[Br])nn1
Stereo: RACEMIC MIXTURE
logP: 6.9647
logD: 6.9647
logSw: -5.7834
Hydrogen bond acceptors count: 5
Hydrogen bond donors count: 1
Polar surface area: 53.316
InChI Key: APYHVUZLFVCXGX-GOSISDBHSA-N
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