2-Amino-3-benzoyl-alpha-(methylthio)benzeneacetamide

The 2-Amino-3-benzoyl-alpha-(methylthio)benzeneacetamide with CAS registry number of 78281-61-5 is also known as 2-Amino-3-benzoyl-a-methylthio-phenylacetamide. The IUPAC name is 2-(2-Amino-3-benzoylphenyl)-2-methylsulfanylacetamide. It belongs to product categories of API. In addition, the formula is C₁₆H₁₆N₂O₂S and the molecular weight is 300.37.

Physical properties about 2-Amino-3-benzoyl-alpha-(methylthio)benzeneacetamide are: (1)ACD/LogP: 1.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.58; (4)ACD/LogD (pH 7.4): 1.58; (5)ACD/BCF (pH 5.5): 9.34; (6)ACD/BCF (pH 7.4): 9.34; (7)ACD/KOC (pH 5.5): 172.23; (8)ACD/KOC (pH 7.4): 172.23; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 111.48Ų; (13)Index of Refraction: 1.654; (14)Molar Refractivity: 86.02 cm³; (15)Molar Volume: 234.6 cm³; (16)Polarizability: 34.1×10^-24cm³; (17)Surface Tension: 59.7 dyne/cm; (18)Density: 1.28 g/cm³; (19)Flash Point: 291.2 °C; (20)Enthalpy of Vaporization: 83.98 kJ/mol; (21)Boiling Point: 557.9 °C at 760 mmHg; (22)Vapour Pressure: 1.76E-12 mmHg at 25 °C.

Uses of 2-Amino-3-benzoyl-alpha-(methylthio)benzeneacetamide: it is used to produce 2-(2-amino-3-benzoyl-phenyl)-acetamide. The reaction occurs with reagent raney nickel and solvent tetrahydrofuran for 15 minutes. The yield is about 73%.

You can still convert the following datas into molecular structure:
1. Canonical SMILES: CSC(C1=CC=CC(=C1N)C(=O)C2=CC=CC=C2)C(=O)N
2. InChI: InChI=1S/C16H16N2O2S/c1-21-15(16(18)20)12-9-5-8-11(13(12)17)14(19)10-6-
3-2-4-7-10/h2-9,15H,17H2,1H3,(H2,18,20)
3. InChIKey: FPRGALQPEHLMNK-UHFFFAOYSA-N