2-[4-(2H-1,3-benzodioxol-5-yl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide

Chemical Structure Depiction of
2-[4-(2H-1,3-benzodioxol-5-yl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide
Available: 14 mg
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mg
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Compound characteristics

Compound ID: V020-3094
Compound Name: 2-[4-(2H-1,3-benzodioxol-5-yl)-1-(2,4-dimethylphenyl)-7-oxo-3-phenyl-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-(2-methoxyethyl)acetamide
Molecular Weight: 584.69
Molecular Formula: C32 H32 N4 O5 S
Smiles: Cc1ccc(c(C)c1)n1c2c(C(c3ccc4c(c3)OCO4)SCC(N2CC(NCCOC)=O)=O)c(c2ccccc2)n1
Stereo: RACEMIC MIXTURE
logP: 5.5337
logD: 5.5337
logSw: -5.4286
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 79.766
InChI Key: HZCXFVMTEFBPEA-WJOKGBTCSA-N
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