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Search term: MQKDXIHEYWTCLH-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(3-Fluorophenyl)-2-{2-[(7-{3-[(2-hydroxyethyl)(2-propyn-1-yl)amino]propoxy}-6-methoxy-4-quinazolinyl)amino]-1,3-thiazol-5-yl}acetamide | C28H29FN6O4S

N-(3-Fluorophenyl)-2-{2-[(7-{3-[(2-hydroxyethyl)(2-propyn-1-yl)amino]propoxy}-6-methoxy-4-quinazolinyl)amino]-1,3-thiazol-5-yl}acetamide

  • Molecular FormulaC28H29FN6O4S
  • Average mass564.631 Da
  • Monoisotopic mass564.195496 Da
  • ChemSpider ID9752491

More details:

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

5-Thiazoleacetamide, N-(3-fluorophenyl)-2-[[7-[3-[(2-hydroxyethyl)-2-propyn-1-ylamino]propoxy]-6-methoxy-4-quinazolinyl]amino]- [ACD/Index Name]
N-(3-Fluorophenyl)-2-{2-[(7-{3-[(2-hydroxyethyl)(2-propyn-1-yl)amino]propoxy}-6-methoxy-4-quinazolinyl)amino]-1,3-thiazol-5-yl}acetamide [ACD/IUPAC Name]
N-(3-Fluorophényl)-2-{2-[(7-{3-[(2-hydroxyéthyl)(2-propyn-1-yl)amino]propoxy}-6-méthoxy-4-quinazolinyl)amino]-1,3-thiazol-5-yl}acétamide [French] [ACD/IUPAC Name]
N-(3-fluorophenyl)-2-{2-[(7-{3-[(2-hydroxyethyl)(prop-2-yn-1-yl)amino]propoxy}-6-methoxyquinazolin-4-yl)amino]-1,3-thiazol-5-yl}acetamide
N-(3-Fluorphenyl)-2-{2-[(7-{3-[(2-hydroxyethyl)(2-propin-1-yl)amino]propoxy}-6-methoxy-4-chinazolinyl)amino]-1,3-thiazol-5-yl}acetamid [German] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL377289/
N-(3-fluorophenyl)-2-(2-(7-(3-((2-hydroxyethyl)(prop-2-ynyl)amino)propoxy)-6-methoxyquinazolin-4-ylamino)thiazol-5-yl)acetamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 153.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 2
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 11.18
ACD/KOC (pH 5.5): 93.52
ACD/LogD (pH 7.4): 3.14
ACD/BCF (pH 7.4): 140.49
ACD/KOC (pH 7.4): 1175.23
Polar Surface Area: 150 Å2
Polarizability: 61.0±0.5 10-24cm3
Surface Tension: 66.2±3.0 dyne/cm
Molar Volume: 408.8±3.0 cm3

Click to predict properties on the Chemicalize site


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