N-(3-fluoro-4-(2-(1-methyl-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-phenylacetamide

The MGCD-265, with CAS registry number 875337-44-3, has the systematic name of N-[(3-fluoro-4-{[2-(1-methyl-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxy}phenyl)carbamothioyl]-2-phenylacetamide. Its molecular weight is 517.60. And the chemical formula of this chemical is C₂₆H₂₀FN₅O₂S₂.

Physical properties of MGCD-265: (1)ACD/LogP: 3.38; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.38; (4)ACD/LogD (pH 7.4): 3.38; (5)ACD/BCF (pH 5.5): 219.56; (6)ACD/BCF (pH 7.4): 219.56; (7)ACD/KOC (pH 5.5): 1650.77; (8)ACD/KOC (pH 7.4): 1650.77; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 26.02 Å²; (13)Index of Refraction: 1.504; (14)Molar Refractivity: 43.15 cm³; (15)Molar Volume: 145.6 cm³; (16)Polarizability: 17.1×10^-24cm³; (17)Surface Tension: 32.5 dyne/cm; (18)Density: 1.771 g/cm³; (19)Flash Point: 72.1 °C; (20)Enthalpy of Vaporization: 43.19 kJ/mol; (21)Boiling Point: 195.7 °C at 760 mmHg; (22)Vapour Pressure: 0.414 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cn1cc(nc1)c2cc3c(s2)c(ccn3)Oc4ccc(cc4F)NC(=S)NC(=O)Cc5ccccc5
(2)InChI: InChI=1/C26H20FN5O2S2/c1-32-14-20(29-15-32)23-13-19-25(36-23)22(9-10-28-19)34-21-8-7-17(12-18(21)27)30-26(35)31-24(33)11-16-5-3-2-4-6-16/h2-10,12-15H,11H2,1H3,(H2,30,31,33,35)
(3)InChIKey: UFICVEHDQUKCEA-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C26H20FN5O2S2/c1-32-14-20(29-15-32)23-13-19-25(36-23)22(9-10-28-19)34-21-8-7-17(12-18(21)27)30-26(35)31-24(33)11-16-5-3-2-4-6-16/h2-10,12-15H,11H2,1H3,(H2,30,31,33,35)
(5)Std. InChIKey: UFICVEHDQUKCEA-UHFFFAOYSA-N