3-(5-bromo-2-methoxyphenyl)-5,7-dimethyl-9-(3-methylbutyl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purine-6,8(7H)-dione

Chemical Structure Depiction of
3-(5-bromo-2-methoxyphenyl)-5,7-dimethyl-9-(3-methylbutyl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purine-6,8(7H)-dione
Available: 44 mg
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mg
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Compound characteristics

Compound ID: F722-1022
Compound Name: 3-(5-bromo-2-methoxyphenyl)-5,7-dimethyl-9-(3-methylbutyl)-5,9-dihydro-6H-[1,2,4]triazolo[4,3-e]purine-6,8(7H)-dione
Molecular Weight: 475.34
Molecular Formula: C20 H23 Br N6 O3
Smiles: CC(C)CCN1C2=C(N(C)C(N(C)C2=O)=O)n2c(c3cc(ccc3OC)[Br])nnc12
Stereo: ACHIRAL
logP: 3.9884
logD: 3.9884
logSw: -4.2078
Hydrogen bond acceptors count: 7
Polar surface area: 65.374
InChI Key: VTWMBTHORUOWIX-UHFFFAOYSA-N
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