6,6-dimethyl-9-(methylsulfanyl)-11-pentyl-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one

Chemical Structure Depiction of
6,6-dimethyl-9-(methylsulfanyl)-11-pentyl-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Available: 247 mg
Amount:
mg
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Compound characteristics

Compound ID: D461-0034
Compound Name: 6,6-dimethyl-9-(methylsulfanyl)-11-pentyl-6,11-dihydrobenzo[h][1,2,4]triazolo[3,4-b]quinazolin-7(5H)-one
Molecular Weight: 382.53
Molecular Formula: C21 H26 N4 O S
Smiles: CCCCCN1C2=NC3=C(C(N2C(=N1)SC)=O)C(C)(C)Cc1ccccc13
Stereo: ACHIRAL
logP: 5.2153
logD: 5.2122
logSw: -4.9577
Hydrogen bond acceptors count: 5
Polar surface area: 42.819
InChI Key: IADHZYLPWKZGEM-UHFFFAOYSA-N
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