2-[4-(4-fluorophenyl)-1-(4-methoxyphenyl)-7-oxo-3-phenyl-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(pyridin-2-yl)methyl]acetamide

Chemical Structure Depiction of
2-[4-(4-fluorophenyl)-1-(4-methoxyphenyl)-7-oxo-3-phenyl-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(pyridin-2-yl)methyl]acetamide
Available: 31 mg
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mg
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Compound characteristics

Compound ID: V020-7887
Compound Name: 2-[4-(4-fluorophenyl)-1-(4-methoxyphenyl)-7-oxo-3-phenyl-1,4,6,7-tetrahydro-8H-pyrazolo[3,4-e][1,4]thiazepin-8-yl]-N-[(pyridin-2-yl)methyl]acetamide
Molecular Weight: 593.68
Molecular Formula: C33 H28 F N5 O3 S
Salt: not_available
Smiles: COc1ccc(cc1)n1c2c(C(c3ccc(cc3)F)SCC(N2CC(NCc2ccccn2)=O)=O)c(c2ccccc2)n1
Stereo: RACEMIC MIXTURE
logP: 5.2527
logD: 5.2517
logSw: -5.1623
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 71.583
InChI Key: VEDVOLDWKWRUIA-JGCGQSQUSA-N
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