4-Methyl-3-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]-N-[3-(trifluoromethyl)phenyl]benzamide (870223-96-4)

The 4-Methyl-3-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]-N-[3-(trifluoromethyl)phenyl]benzamide, with CAS registry number 870223-96-4, has the systematic name of 4-methyl-3-({3-[2-(methylamino)pyrimidin-4-yl]pyridin-2-yl}oxy)-N-[3-(trifluoromethyl)phenyl]benzamide. And the chemical formula of this chemical is C₂₅H₂₀F₃N₅O₂.

Physical properties of 4-Methyl-3-[[3-[2-(methylamino)-4-pyrimidinyl]-2-pyridinyl]oxy]-N-[3-(trifluoromethyl)phenyl]benzamide: (1)ACD/LogP: 4.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.79; (4)ACD/LogD (pH 7.4): 4.79; (5)ACD/BCF (pH 5.5): 2550.44; (6)ACD/BCF (pH 7.4): 2550.72; (7)ACD/KOC (pH 5.5): 9550.74; (8)ACD/KOC (pH 7.4): 9551.78; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 71.45 Å²; (13)Index of Refraction: 1.629; (14)Molar Refractivity: 125.55 cm³; (15)Molar Volume: 353 cm³; (16)Polarizability: 49.77×10^-24cm³; (17)Surface Tension: 51.8 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c1cc(ccc1)NC(=O)c4cc(Oc3ncccc3c2nc(ncc2)NC)c(cc4)C
(2)InChI: InChI=1/C25H20F3N5O2/c1-15-8-9-16(22(34)32-18-6-3-5-17(14-18)25(26,27)28)13-21(15)35-23-19(7-4-11-30-23)20-10-12-31-24(29-2)33-20/h3-14H,1-2H3,(H,32,34)(H,29,31,33)
(3)InChIKey: ZVIWALRWYYSHSU-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C25H20F3N5O2/c1-15-8-9-16(22(34)32-18-6-3-5-17(14-18)25(26,27)28)13-21(15)35-23-19(7-4-11-30-23)20-10-12-31-24(29-2)33-20/h3-14H,1-2H3,(H,32,34)(H,29,31,33)
(5)Std. InChIKey: ZVIWALRWYYSHSU-UHFFFAOYSA-N