ChemSpider 2D Image | (2Z)-2-(1,3-Benzodioxol-5-ylimino)-3-ethyl-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide | C20H18FN3O4S

(2Z)-2-(1,3-Benzodioxol-5-ylimino)-3-ethyl-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide

  • Molecular FormulaC20H18FN3O4S
  • Average mass415.438 Da
  • Monoisotopic mass415.100189 Da
  • ChemSpider ID17785153

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-(1,3-Benzodioxol-5-ylimino)-3-ethyl-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide [ACD/IUPAC Name]
(2Z)-2-(1,3-Benzodioxol-5-ylimino)-3-éthyl-N-(4-fluorophényl)-4-oxo-1,3-thiazinane-6-carboxamide [French] [ACD/IUPAC Name]
(2Z)-2-(1,3-Benzodioxol-5-ylimino)-3-ethyl-N-(4-fluorphenyl)-4-oxo-1,3-thiazinan-6-carboxamid [German] [ACD/IUPAC Name]
2H-1,3-Thiazine-6-carboxamide, 2-(1,3-benzodioxol-5-ylimino)-3-ethyl-N-(4-fluorophenyl)tetrahydro-4-oxo-, (2Z)- [ACD/Index Name]
(Z)-2-(benzo[d][1,3]dioxol-5-ylimino)-3-ethyl-N-(4-fluorophenyl)-4-oxo-1,3-thiazinane-6-carboxamide
2-(Benzo[1,3]dioxol-5-ylimino)-3-ethyl-4-oxo-[1,3]thiazinane-6-carboxylic acid (4-fluoro-phenyl)-amide
442555-24-0 [RN]
AC1MH8MH
AGN-PC-0K0Z1O
CHEMBL3207672
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MLS000054369 [DBID]
SMR000066119 [DBID]

    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: 1.672
    Molar Refractivity: 106.6±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.17
    ACD/LogD (pH 5.5): 2.04
    ACD/BCF (pH 5.5): 20.88
    ACD/KOC (pH 5.5): 306.44
    ACD/LogD (pH 7.4): 2.04
    ACD/BCF (pH 7.4): 20.88
    ACD/KOC (pH 7.4): 306.43
    Polar Surface Area: 106 Å2
    Polarizability: 42.2±0.5 10-24cm3
    Surface Tension: 54.4±7.0 dyne/cm
    Molar Volume: 284.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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