ChemSpider 2D Image | 2-[(6-Amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(3-methylbutyl)amino]-2-oxoethyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanoate | C28H37N5O7

2-[(6-Amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(3-methylbutyl)amino]-2-oxoethyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanoate

  • Molecular FormulaC28H37N5O7
  • Average mass555.623 Da
  • Monoisotopic mass555.269287 Da
  • ChemSpider ID10972076

More details:






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

2-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-méthylbutanoate de 2-[(6-amino-1-butyl-2,4-dioxo-1,2,3,4-tétrahydro-5-pyrimidinyl)(3-méthylbutyl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]
2-[(6-Amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(3-methylbutyl)amino]-2-oxoethyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanoate [ACD/IUPAC Name]
2-[(6-Amino-1-butyl-2,4-dioxo-1,2,3,4-tetrahydro-5-pyrimidinyl)(3-methylbutyl)amino]-2-oxoethyl-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-methylbutanoat [German] [ACD/IUPAC Name]
2H-Isoindole-2-acetic acid, 1,3-dihydro-α-(1-methylethyl)-1,3-dioxo-, 2-[(6-amino-1-butyl-1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinyl)(3-methylbutyl)amino]-2-oxoethyl ester [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.604
Molar Refractivity: 145.3±0.4 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.85
ACD/BCF (pH 5.5): 14.98
ACD/KOC (pH 5.5): 240.75
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 14.31
ACD/KOC (pH 7.4): 229.97
Polar Surface Area: 159 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 62.4±5.0 dyne/cm
Molar Volume: 422.2±5.0 cm3

Click to predict properties on the Chemicalize site






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