MK-0752

Description: MK-0752 is a moderately potent 纬-secretase inhibitor, which reduces A尾40 production with IC50 of 5 nM and in Phase 2.

• Catalog: OFC471905416
• CAS: 471905-41-6
• Category: Fluorinated APIs
• Synonyms: cis-4-[(4-Chlorophenyl)sulfonyl]-4-(2,5-difluorophenyl)cyclohexanepropanoic acid
• Purity: >98%

• IUPAC Name: 3-[4-(4-chlorophenyl)sulfonyl-4-(2,5-difluorophenyl)cyclohexyl]propanoic acid
• InChI: InChI=1S/C21H21ClF2O4S/c22-15-2-5-17(6-3-15)29(27,28)21(18-13-16(23)4-7-19(18)24)11-9-14(10-12-21)1-8-20(25)26/h2-7,13-14H,1,8-12H2,(H,25,26)
• InChI Key: XCGJIFAKUZNNOR-UHFFFAOYSA-N
• Isomeric SMILES: C1CC(CCC1CCC(=O)O)(C2=C(C=CC(=C2)F)F)S(=O)(=O)C3=CC=C(C=C3)Cl

• Molecular Formula: C21H21ClF2O4S
• Molecular Weight: 442.9
• Appearance: White to off-white solid powder

• XLogP3-AA: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 442.0817143 g/mol
• Monoisotopic Mass: 442.0817143 g/mol
• Topological Polar Surface Area: 79.8Ų
• Heavy Atom Count: 29
• Formal Charge: 0
• Complexity: 665