2-(3-Chloro-5-(trifluoromethyl)pyridin-2-yl)-5-methoxypyrimidin-4(3h)-one

• Catalog: OFC2379918315
• CAS: 2379918-31-5
• Category: Fluorinated Pyrimidines
• Synonyms: 2-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-5-methoxy-1H-pyrimidin-6-one
• MDL Number: MFCD31812113

• IUPAC Name: 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-5-methoxy-1H-pyrimidin-6-one
• InChI: InChI=1S/C11H7ClF3N3O2/c1-20-7-4-17-9(18-10(7)19)8-6(12)2-5(3-16-8)11(13,14)15/h2-4H,1H3,(H,17,18,19)
• InChI Key: LHSBPTZWKUCBAZ-UHFFFAOYSA-N
• Isomeric SMILES: COC1=CN=C(NC1=O)C2=C(C=C(C=N2)C(F)(F)F)Cl

• Molecular Formula: C11H7ClF3N3O2
• Molecular Weight: 305.64

• XLogP3-AA: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 2
• Exact Mass: 305.0178887 g/mol
• Monoisotopic Mass: 305.0178887 g/mol
• Topological Polar Surface Area: 63.6Ų
• Heavy Atom Count: 20
• Formal Charge: 0
• Complexity: 464