{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-nitrophenyl)methanone

Chemical Structure Depiction of
{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-nitrophenyl)methanone
Available: 2 mg
Amount:
mg
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Compound characteristics

Compound ID: V011-1229
Compound Name: {4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-nitrophenyl)methanone
Molecular Weight: 499.57
Molecular Formula: C27 H29 N7 O3
Salt: not_available
Smiles: CC(C)Cc1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O
Stereo: ACHIRAL
logP: 5.1827
logD: 5.0991
logSw: -5.0881
Hydrogen bond acceptors count: 9
Polar surface area: 87.781
InChI Key: RGNDLNRMVQBXLM-UHFFFAOYSA-N
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