2-(dodecylsulfanyl)-5-(7,8,9-triazatricyclo[4.3.0.0~7,9~]nona-1,3,5-trien-8-yl)benzene-1,4-diol

Chemical Structure Depiction of
2-(dodecylsulfanyl)-5-(7,8,9-triazatricyclo[4.3.0.0~7,9~]nona-1,3,5-trien-8-yl)benzene-1,4-diol
Available: 3 mg
Amount:
mg
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Compound characteristics

Compound ID: 8007-9417
Compound Name: 2-(dodecylsulfanyl)-5-(7,8,9-triazatricyclo[4.3.0.0~7,9~]nona-1,3,5-trien-8-yl)benzene-1,4-diol
Molecular Weight: 427.61
Molecular Formula: C24 H33 N3 O2 S
Smiles: CCCCCCCCCCCCSc1cc(c(cc1O)n1n2c3ccccc3n12)O
Stereo: ACHIRAL
logP: 8.4142
logD: 8.4135
logSw: -5.7187
Hydrogen bond acceptors count: 3
Hydrogen bond donors count: 2
Polar surface area: 36.663
InChI Key: DJOYLZLEGMJMAN-UHFFFAOYSA-N
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