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Predicted properties of the compound entered.

ID GEJZIRAGAVZMCP-GHMZBOCLSA-N
Formula C23H26Cl2F2N6O2
IUPAC Name (2R)-2-{[5-chloro-6-(4-chloro-2,6-difluorophenyl)-7-{[(2R)-3,3-dimethylbutan-2-yl]amino}pyrazolo[1,5-a]pyrimidin-3-yl]formamido}-N-methylpropanamide
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C23H26Cl2F2N6O2/c1-10(21(34)28-6)30-22(35)13-9-29-33-19(13)32-18(25)17(20(33)31-11(2)23(3,4)5)16-14(26)7-12(24)8-15(16)27/h7-11,31H,1-6H3,(H,28,34)(H,30,35)/t10-,11-/m1/s1
Standard InChIKey (User Input) InChIKey=GEJZIRAGAVZMCP-GHMZBOCLSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers
This prediction is based on QSPR only and is the first basic approximate estimation.
For more property data (~2,100 data sets per compound) with higher accuracy , try our new database.
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
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13C NMR prediction -
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HSQC/HMBC prediction -
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