ChemSpider 2D Image | ethyl (2Z)-5-(4-tert-butylphenyl)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C30H31N3O4S

ethyl (2Z)-5-(4-tert-butylphenyl)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC30H31N3O4S
  • Average mass529.650 Da
  • Monoisotopic mass529.203552 Da
  • ChemSpider ID2372251

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-(1-Éthyl-2-oxo-1,2-dihydro-3H-indol-3-ylidène)-7-méthyl-5-[4-(2-méthyl-2-propanyl)phényl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate d'éthyle [French] [ACD/IUPAC Name]
5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-[4-(1,1-dimethylethyl)phenyl]-2-(1-ethyl-1,2-dihydro-2-oxo-3H-indol-3-ylidene)-2,3-dihydro-7-methyl-3-oxo-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-5-[4-(2-methyl-2-propanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
ethyl (2Z)-5-(4-tert-butylphenyl)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Ethyl-(2Z)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-yliden)-7-methyl-5-[4-(2-methyl-2-propanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
324568-05-0 [RN]
5-(4-tert-Butyl-phenyl)-2-(1-ethyl-2-oxo-1,2-dihydro-indol-3-ylidene)-7-methyl-3-oxo-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
AC1MJURH
AKOS003623835
AKOS022079500
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AG-690/12071151 [DBID]
BAS 00780954 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 608.3±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 90.4±3.0 kJ/mol
    Flash Point: 321.7±34.3 °C
    Index of Refraction: 1.651
    Molar Refractivity: 150.2±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 5.88
    ACD/LogD (pH 5.5): 5.02
    ACD/BCF (pH 5.5): 3843.16
    ACD/KOC (pH 5.5): 12808.96
    ACD/LogD (pH 7.4): 5.02
    ACD/BCF (pH 7.4): 3843.16
    ACD/KOC (pH 7.4): 12808.96
    Polar Surface Area: 105 Å2
    Polarizability: 59.5±0.5 10-24cm3
    Surface Tension: 47.8±7.0 dyne/cm
    Molar Volume: 411.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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