ChemSpider 2D Image | 2-Methyl-2-propanyl [1-{(2E)-2-[(6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)methylene]hydrazino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamate | C16H25N5O5S

2-Methyl-2-propanyl [1-{(2E)-2-[(6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)methylene]hydrazino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamate

  • Molecular FormulaC16H25N5O5S
  • Average mass399.465 Da
  • Monoisotopic mass399.157654 Da
  • ChemSpider ID26012566
  • Double-bond stereo - Double-bond stereo


More details:






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

[1-{(2E)-2-[(6-Méthyl-2,4-dioxo-1,2,3,4-tétrahydro-5-pyrimidinyl)méthylène]hydrazino}-4-(méthylsulfanyl)-1-oxo-2-butanyl]carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl [1-{(2E)-2-[(6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)methylene]hydrazino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-[1-{(2E)-2-[(6-methyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)methylen]hydrazino}-4-(methylsulfanyl)-1-oxo-2-butanyl]carbamat [German] [ACD/IUPAC Name]
[1-(2,4-Dihydroxy-6-methyl-pyrimidin-5-ylmethylene-hydrazinocarbonyl)-3-methylsulfanyl-propyl]-carbamic acid tert-butyl ester
tert-butyl [1-{(2E)-2-[(2,4-dihydroxy-6-methylpyrimidin-5-yl)methylidene]hydrazinyl}-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamate (non-preferred name)

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: 1.599
Molar Refractivity: 101.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.46
ACD/LogD (pH 5.5): -2.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 171 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 296.3±7.0 cm3

Click to predict properties on the Chemicalize site






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