ChemSpider 2D Image | N-(3-Chloro-4-fluorobenzyl)-2-[3-(4-fluorobenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide | C22H16ClF2N3O3S

N-(3-Chloro-4-fluorobenzyl)-2-[3-(4-fluorobenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide

  • Molecular FormulaC22H16ClF2N3O3S
  • Average mass475.896 Da
  • Monoisotopic mass475.056885 Da
  • ChemSpider ID26010097

More details:

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

N-(3-Chlor-4-fluorbenzyl)-2-[3-(4-fluorbenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamid [German] [ACD/IUPAC Name]
N-(3-Chloro-4-fluorobenzyl)-2-[3-(4-fluorobenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl]acetamide [ACD/IUPAC Name]
N-(3-Chloro-4-fluorobenzyl)-2-[3-(4-fluorobenzyl)-2,4-dioxo-3,4-dihydrothiéno[3,2-d]pyrimidin-1(2H)-yl]acétamide [French] [ACD/IUPAC Name]
Thieno[3,2-d]pyrimidine-1(2H)-acetamide, N-[(3-chloro-4-fluorophenyl)methyl]-3-[(4-fluorophenyl)methyl]-3,4-dihydro-2,4-dioxo- [ACD/Index Name]
1252897-77-0 [RN]
MFCD06626238
N-(3-Chloro-4-fluoro-benzyl)-2-[3-(4-fluoro-benzyl)-2,4-dioxo-3,4-dihydro-2H-thieno[3,2-d]pyrimidin-1-yl]-acetamide
N-[(3-chloro-4-fluorophenyl)methyl]-2-[3-[(4-fluorophenyl)methyl]-2,4-dioxothieno[3,2-d]pyrimidin-1-yl]acetamide
N-[(3-chloro-4-fluorophenyl)methyl]-2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}acetamide

    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: 1.642
    Molar Refractivity: 115.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.43
    ACD/LogD (pH 5.5): 4.19
    ACD/BCF (pH 5.5): 902.32
    ACD/KOC (pH 5.5): 4539.90
    ACD/LogD (pH 7.4): 4.19
    ACD/BCF (pH 7.4): 902.32
    ACD/KOC (pH 7.4): 4539.90
    Polar Surface Area: 98 Å2
    Polarizability: 45.9±0.5 10-24cm3
    Surface Tension: 60.6±3.0 dyne/cm
    Molar Volume: 320.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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