Found 5 results

Search term: MF = 'C_{30}H_{49}N_{5}O_{6}S'
ChemSpider 2D Image | 2-Methyl-2-propanyl N-[4-(dihexylamino)-1,1-dioxido-1,2,5-thiadiazol-3-yl]-O-(dimethylcarbamoyl)-L-tyrosinate | C30H49N5O6S

2-Methyl-2-propanyl N-[4-(dihexylamino)-1,1-dioxido-1,2,5-thiadiazol-3-yl]-O-(dimethylcarbamoyl)-L-tyrosinate

  • Molecular FormulaC30H49N5O6S
  • Average mass607.805 Da
  • Monoisotopic mass607.340332 Da
  • ChemSpider ID8501822

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Methyl-2-propanyl N-[4-(dihexylamino)-1,1-dioxido-1,2,5-thiadiazol-3-yl]-O-(dimethylcarbamoyl)-L-tyrosinate [ACD/IUPAC Name]
2-Methyl-2-propanyl-N-[4-(dihexylamino)-1,1-dioxido-1,2,5-thiadiazol-3-yl]-O-(dimethylcarbamoyl)-L-tyrosinat [German] [ACD/IUPAC Name]
L-Tyrosine, N-[4-(dihexylamino)-1,1-dioxido-1,2,5-thiadiazol-3-yl]-O-[(dimethylamino)carbonyl]-, 1,1-dimethylethyl ester [ACD/Index Name]
N-[4-(Dihexylamino)-1,1-dioxydo-1,2,5-thiadiazol-3-yl]-O-(diméthylcarbamoyl)-L-tyrosinate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 676.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.3±3.0 kJ/mol
Flash Point: 362.6±34.3 °C
Index of Refraction: 1.552
Molar Refractivity: 166.3±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 5.65
ACD/LogD (pH 5.5): 5.84
ACD/BCF (pH 5.5): 16096.95
ACD/KOC (pH 5.5): 35708.73
ACD/LogD (pH 7.4): 5.84
ACD/BCF (pH 7.4): 16096.95
ACD/KOC (pH 7.4): 35708.73
Polar Surface Area: 138 Å2
Polarizability: 65.9±0.5 10-24cm3
Surface Tension: 41.9±7.0 dyne/cm
Molar Volume: 520.4±7.0 cm3

Click to predict properties on the Chemicalize site


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