Basic Information | Post buying leads | Suppliers |
Name |
6-[5-(Cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide |
EINECS | N/A |
CAS No. | 585543-15-3 | Density | 1.21 g/cm3 |
PSA | 78.07000 | LogP | 5.01380 |
Solubility | N/A | Melting Point |
N/A |
Formula | C22H26FN3O2 | Boiling Point | 529.37 °C at 760 mmHg |
Molecular Weight | 383.46 | Flash Point | 273.953 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
GW856553X; |
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