1-[rel-(4'aR,8'aS)-4'a,5',6',7',8',8'a-hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl]-2-methylpropan-1-one

Chemical Structure Depiction of
1-[rel-(4'aR,8'aS)-4'a,5',6',7',8',8'a-hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl]-2-methylpropan-1-one
Available: 21 mg
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mg
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Compound characteristics

Compound ID: D322-0004
Compound Name: 1-[rel-(4'aR,8'aS)-4'a,5',6',7',8',8'a-hexahydro-4'H-spiro[cyclohexane-1,9'-[1,2,4]triazolo[5,1-b]quinazolin]-4'-yl]-2-methylpropan-1-one
Molecular Weight: 316.45
Molecular Formula: C18 H28 N4 O
Smiles: CC(C)C(N1c2ncnn2C2(CCCCC2)[C@@H]2CCCC[C@H]12)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.3803
logD: 3.3803
logSw: -3.5349
Hydrogen bond acceptors count: 4
Polar surface area: 39.1
InChI Key: MGFXWSRUBDBQNM-GJZGRUSLSA-N
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