Predicted properties of the compound entered.

ID AAKGQPUCHFSVQD-ONEGZZNKSA-N
Formula C28H34Cl2FN5O6
IUPAC Name (2E)-N-{4-[(4,5-dichloro-2-fluorophenyl)amino]-7-(2-{2-[2-(2-hydroxyethoxy)ethoxy]ethoxy}ethoxy)quinazolin-6-yl}-4-(dimethylamino)but-2-enamide
SMILES
Standard InChI
Standard InChIKey
Cite this record
Copied
Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C28H34Cl2FN5O6/c1-36(2)5-3-4-27(38)34-25-14-19-23(17-26(25)42-13-12-41-11-10-40-9-8-39-7-6-37)32-18-33-28(19)35-24-16-21(30)20(29)15-22(24)31/h3-4,14-18,37H,5-13H2,1-2H3,(H,34,38)(H,32,33,35)/b4-3+
Standard InChIKey (User Input) InChIKey=AAKGQPUCHFSVQD-ONEGZZNKSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers
For more property data (~2,100 data sets per compound) with higher accuracy , try our new database.
Mol-Instincts Database
 
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 - - -
For professional applications, try our new chemical database based on quantum mechanics - more property data (~2,100 data sets per compound) with higher accuracy.

Mol-Instincts Database

Additional Information Link
1H NMR prediction -
13C NMR prediction -
COSY -
HSQC/HMBC prediction -
All prediction -