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Search term: COCCNC(=O)c1ccc(Nc2ncc3cc(ccc3n2)-c2ccncc2)cc1 (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | N-(2-Methoxyethyl)-4-[(6-Pyridin-4-Ylquinazolin-2-Yl)amino]benzamide | C23H21N5O2

N-(2-Methoxyethyl)-4-[(6-Pyridin-4-Ylquinazolin-2-Yl)amino]benzamide

  • Molecular FormulaC23H21N5O2
  • Average mass399.445 Da
  • Monoisotopic mass399.169525 Da
  • ChemSpider ID29419260

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Benzamide, N-(2-methoxyethyl)-4-[[6-(4-pyridinyl)-2-quinazolinyl]amino]- [ACD/Index Name]
N-(2-Methoxyethyl)-4-[(6-Pyridin-4-Ylquinazolin-2-Yl)amino]benzamide
N-(2-Methoxyethyl)-4-{[6-(4-pyridinyl)-2-chinazolinyl]amino}benzamid [German] [ACD/IUPAC Name]
N-(2-Methoxyethyl)-4-{[6-(4-pyridinyl)-2-quinazolinyl]amino}benzamide [ACD/IUPAC Name]
N-(2-Méthoxyéthyl)-4-{[6-(4-pyridinyl)-2-quinazolinyl]amino}benzamide [French] [ACD/IUPAC Name]
32W
N-(2-methoxyethyl)-4-{[6-(pyridin-4-yl)quinazolin-2-yl]amino}benzamide
UNC-BE1-004
  • Miscellaneous

    • Chemical Class:

      A member of the class of quinazolines that is quinazoline which is substituted by a {4-[(2-methoxyethyl)carbamoyl]phenyl}nitrilo group and a pyridin-4-yl group at positions 2 and 6, respectively. It i s a B-Raf and MKNK2 kinase inhibitor. ChEBI CHEBI:143119

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.667
Molar Refractivity: 117.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 2.85
ACD/BCF (pH 5.5): 79.02
ACD/KOC (pH 5.5): 717.06
ACD/LogD (pH 7.4): 3.00
ACD/BCF (pH 7.4): 112.68
ACD/KOC (pH 7.4): 1022.48
Polar Surface Area: 89 Å2
Polarizability: 46.4±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 314.3±3.0 cm3

Click to predict properties on the Chemicalize site


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