ethyl 2-(2-{[7-methyl-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Chemical Structure Depiction of
ethyl 2-(2-{[7-methyl-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Available: 45 mg
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mg
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Compound characteristics

Compound ID: 4112-4166
Compound Name: ethyl 2-(2-{[7-methyl-4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Molecular Weight: 543.73
Molecular Formula: C26 H29 N3 O4 S3
Smiles: CCOC(c1c2CCCc2sc1NC(CSC1=Nc2c(C(N1CC=C)=O)c1CCC(C)Cc1s2)=O)=O
Stereo: RACEMIC MIXTURE
logP: 5.4952
logD: 3.6441
logSw: -5.3079
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 69.828
InChI Key: BCXOFZOJKLYWSA-CQSZACIVSA-N
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