ChemSpider 2D Image | (2R)-2-{[6-Chloro-3-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2-furylmethyl)propanamide | C22H16ClF2N3O3S

(2R)-2-{[6-Chloro-3-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2-furylmethyl)propanamide

  • Molecular FormulaC22H16ClF2N3O3S
  • Average mass475.896 Da
  • Monoisotopic mass475.056885 Da
  • ChemSpider ID62584400

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-{[6-Chlor-3-(2,4-difluorphenyl)-4-oxo-3,4-dihydro-2-chinazolinyl]sulfanyl}-N-(2-furylmethyl)propanamid [German] [ACD/IUPAC Name]
(2R)-2-{[6-Chloro-3-(2,4-difluorophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2-furylmethyl)propanamide [ACD/IUPAC Name]
(2R)-2-{[6-Chloro-3-(2,4-difluorophényl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2-furylméthyl)propanamide [French] [ACD/IUPAC Name]
Propanamide, 2-[[6-chloro-3-(2,4-difluorophenyl)-3,4-dihydro-4-oxo-2-quinazolinyl]thio]-N-(2-furanylmethyl)-, (2R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.659
Molar Refractivity: 118.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 510.38
ACD/KOC (pH 5.5): 3019.33
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 510.38
ACD/KOC (pH 7.4): 3019.33
Polar Surface Area: 100 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 50.6±7.0 dyne/cm
Molar Volume: 322.4±7.0 cm3

Click to predict properties on the Chemicalize site


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