ChemSpider 2D Image | 2-Methyl-2-propanyl [(1S,2S)-1-{5-[(3,4-dichlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-methylbutyl]carbamate | C19H25Cl2N3O5S

2-Methyl-2-propanyl [(1S,2S)-1-{5-[(3,4-dichlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-methylbutyl]carbamate

  • Molecular FormulaC19H25Cl2N3O5S
  • Average mass478.390 Da
  • Monoisotopic mass477.089203 Da
  • ChemSpider ID22874423

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

[(1S,2S)-1-{5-[(3,4-Dichlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-méthylbutyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [(1S,2S)-1-{5-[(3,4-dichlorobenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-methylbutyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[(1S,2S)-1-{5-[(3,4-dichlorbenzyl)sulfonyl]-1,3,4-oxadiazol-2-yl}-2-methylbutyl]carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-[(1S,2S)-1-[5-[[(3,4-dichlorophenyl)methyl]sulfonyl]-1,3,4-oxadiazol-2-yl]-2-methylbutyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
1173676-50-0 [RN]
SPS-199109
tert-butyl ((1S)-1-(5-((3,4-dichlorobenzyl)sulfonyl)-1,3,4-oxadiazol-2-yl)-2-methylbutyl)carbamate
tert-butyl N-[(1S)-1-[5-[(3,4-dichlorophenyl)methylsulfonyl]-1,3,4-oxadiazol-2-yl]-2-methylbutyl]carbamate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.542
    Molar Refractivity: 114.4±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 4.80
    ACD/LogD (pH 5.5): 4.30
    ACD/BCF (pH 5.5): 1085.15
    ACD/KOC (pH 5.5): 5180.85
    ACD/LogD (pH 7.4): 4.30
    ACD/BCF (pH 7.4): 1084.30
    ACD/KOC (pH 7.4): 5176.80
    Polar Surface Area: 120 Å2
    Polarizability: 45.4±0.5 10-24cm3
    Surface Tension: 49.2±3.0 dyne/cm
    Molar Volume: 363.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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