TYRPHOSTIN B56

The 2-Propenamide,2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenylbutyl)-, (2E)-, with the CAS registry number of 133550-41-1, is also known as 2-Cyano-3-(3,4-dihydroxy-phenyl)-N-(4-phenyl-butyl)-acrylamide. It belongs to the product categories of Protein Kinase; Intracellular Signaling. Its molecular formula is C₂₀H₂₀N₂O₃ and molecular weight is 336.38. What's more, its systematic name is (2E)-2-Cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenylbutyl)prop-2-enamide. In addition, it must be stored in airtight containers and placed in a dry, cool place.

Physical properties about the 2-Propenamide,2-cyano-3-(3,4-dihydroxyphenyl)-N-(4-phenylbutyl)-, (2E)- are: (1)ACD/LogP: 3.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.19; (4)ACD/LogD (pH 7.4): 3.17; (5)ACD/BCF (pH 5.5): 157.75; (6)ACD/BCF (pH 7.4): 148.43; (7)ACD/KOC (pH 5.5): 1302.59; (8)ACD/KOC (pH 7.4): 1225.62; (9)#H bond acceptors: 5; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 62.56 Å²; (13)Index of Refraction: 1.638; (14)Molar Refractivity: 96.93 cm³; (15)Molar Volume: 269.6 cm³; (16)Surface Tension: 59.4 dyne/cm; (17)Density: 1.247 g/cm³; (18)Flash Point: 338.5 °C; (19)Enthalpy of Vaporization: 97.41 kJ/mol; (20)Boiling Point: 636.1 °C at 760 mmHg; (21)Vapour Pressure: 8.95E-17 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
The dust of this chemical can not be breathed. And you should avoid contacting with skin and eyes.

You can still convert the following datas into molecular structure:
(1) SMILES: N#C/C(=C\c1cc(O)c(O)cc1)C(=O)NCCCCc2ccccc2
(2) InChI: InChI=1/C20H20N2O3/c21-14-17(12-16-9-10-18(23)19(24)13-16)20(25)22-11-5-4-8-15-6-2-1-3-7-15/h1-3,6-7,9-10,12-13,23-24H,4-5,8,11H2,(H,22,25)/b17-12+
(3) InChIKey: GWCNJMUSWLTSCW-SFQUDFHCBU