6-[5-(Cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide supplier

Name
Losmapimod (GW856553X)
EINECS
CAS No. 585543-15-3
Density 1.21 g/cm³
Solubility
Melting Point
Formula C₂₂H₂₆FN₃O₂
Boiling Point 529.37 °C at 760 mmHg
Molecular Weight 383.46
Flash Point 273.953 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms GW856553X;
PSA 78.07000
LogP 5.01380

6-[5-(Cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide Specification

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

Product Name

Losmapimod (GW856553X)

6-[5-(Cyclopropylcarbamoyl)-3-fluoro-2-methylphenyl]-N-(2,2-dimethylpropyl)pyridine-3-carboxamide Specification

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