6-[5-(Cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide (585543-15-3)

The 6-[5-(Cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide, with the cas number 585543-15-3, is also called GW856553X. Its molecular formula is C₂₂H₂₆FN₃O₂. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: 4.03; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 71.09 Å²; (7)Index of Refraction: 1.582; (8)Molar Refractivity: 105.767 cm³; (9)Molar Volume: 316.972 cm³; (10)Polarizability: 41.929×10^-24cm³; (11)Surface Tension: 51.068 dyne/cm; (12)Enthalpy of Vaporization: 80.44 kJ/mol ; (13)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NC1CC1)c2cc(c(c(F)c2)C)c3ncc(cc3)C(=O)NCC(C)(C)C
(2)InChI: InChI=1/C22H26FN3O2/c1-13-17(9-15(10-18(13)23)21(28)26-16-6-7-16)19-8-5-14(11-24-19)20(27)25-12-22(2,3)4/h5,8-11,16H,6-7,12H2,1-4H3,(H,25,27)(H,26,28)
(3)InChIKey: KKYABQBFGDZVNQ-UHFFFAOYAE