2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-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-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-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: 36 mg
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mg
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Compound characteristics

Compound ID: V014-4176
Compound Name: 2-[1-(2-chlorophenyl)-4-(4-fluorophenyl)-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: 598.1
Molecular Formula: C32 H25 Cl F N5 O2 S
Salt: not_available
Smiles: C(c1ccccn1)NC(CN1C(CSC(c2ccc(cc2)F)c2c(c3ccccc3)nn(c3ccccc3[Cl])c12)=O)=O
Stereo: RACEMIC MIXTURE
logP: 5.6867
logD: 5.6858
logSw: -5.9717
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 63.738
InChI Key: SSJXZNUAXRVULW-WJOKGBTCSA-N
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