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N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide

Chemical Structure Depiction of
N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Available: 5 mg
Amount:
mg
Format:
$83.09
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Compound characteristics

Compound ID: Y500-1247
Compound Name: N-(7-tert-butyl-2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)-1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
Molecular Weight: 458.54
Molecular Formula: C21 H26 N6 O4 S
Smiles: CCn1cc(c(C(NN2C(C)=Nc3c(C2=O)c2CCC(Cc2s3)C(C)(C)C)=O)n1)[N+]([O-])=O
Stereo: RACEMIC MIXTURE
logP: 2.883
logD: 2.8089
logSw: -3.2989
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 1
Polar surface area: 98.739
InChI Key: PHWOVFBYTDNIOV-GFCCVEGCSA-N
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