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AKT Kinase Inhibitor

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Name

AKT Kinase Inhibitor

EINECS N/A
CAS No. 842148-40-7 Density 1.507 g/cm3
PSA 151.13000 LogP 1.43630
Solubility N/A Melting Point N/A
Formula C16H19N7O3 Boiling Point 678.806 °C at 760 mmHg
Molecular Weight 357.37 Flash Point 364.329 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 842148-40-7 (AKT Kinase Inhibitor) Hazard Symbols N/A
Synonyms

2-Propyn-1-ol, 3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-7-(3-aminopropoxy)-1-ethyl-1H-imidazo[4,5-c]pyridin-4-yl]-;

 

AKT Kinase Inhibitor Specification

AKT Kinase Inhibitor is an organic compound with the formula C16H19N7O3, and its systematic name is the same with the product name. With the CAS registry number 842148-40-7, it is also named as 2-Propyn-1-ol, 3-[2-(4-amino-1,2,5-oxadiazol-3-yl)-7-(3-aminopropoxy)-1-ethyl-1H-imidazo[4,5-c]pyridin-4-yl]-. In addition, the molecular weight is 357.37.

Physical properties of AKT Kinase Inhibitor are: (1)ACD/LogP: 2.771; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): -0.23; (4)ACD/LogD (pH 7.4): 1.01; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.31; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 13.32; (9)#H bond acceptors: 10; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 9; (12)Polar Surface Area: 151.13 Å2; (13)Index of Refraction: 1.704; (14)Molar Refractivity: 92.084 cm3; (15)Molar Volume: 237.171 cm3; (16)Polarizability: 36.505×10-24cm3; (17)Surface Tension: 64.34 dyne/cm; (18)Density: 1.507 g/cm3; (19)Flash Point: 364.329 °C; (20)Enthalpy of Vaporization: 104.65 kJ/mol; (21)Boiling Point: 678.806 °C at 760 mmHg ; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCn1c2c(cnc(c2nc1c3c(non3)N)C#CCO)OCCCN
(2)Std. InChI: InChI=1S/C16H19N7O3/c1-2-23-14-11(25-8-4-6-17)9-19-10(5-3-7-24)12(14)20-16(23)13-15(18)22-26-21-13/h9,24H,2,4,6-8,17H2,1H3,(H2,18,22)
(3)Std. InChIKey: LWLOLQIXHMFYND-UHFFFAOYSA-N 

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