ChemSpider 2D Image | (2R)-2-Amino-N-[(1R)-1-[(5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]-2-(dodecylamino)-2-oxoethyl]-3-(4-methoxyphenyl)propanamide | C32H49N5O8

(2R)-2-Amino-N-[(1R)-1-[(5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]-2-(dodecylamino)-2-oxoethyl]-3-(4-methoxyphenyl)propanamide

  • Molecular FormulaC32H49N5O8
  • Average mass631.760 Da
  • Monoisotopic mass631.358093 Da
  • ChemSpider ID8027947

  • defined stereocentres - 3 of 6 defined stereocentres

More details:

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

(2R)-2-Amino-N-[(1R)-1-[(5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]-2-(dodecylamino)-2-oxoethyl]-3-(4-methoxyphenyl)propanamid [German] [ACD/IUPAC Name]
(2R)-2-Amino-N-[(1R)-1-[(5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytetrahydro-2-furanyl]-2-(dodecylamino)-2-oxoethyl]-3-(4-methoxyphenyl)propanamide [ACD/IUPAC Name]
(2R)-2-Amino-N-[(1R)-1-[(5R)-5-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-3,4-dihydroxytétrahydro-2-furanyl]-2-(dodécylamino)-2-oxoéthyl]-3-(4-méthoxyphényl)propanamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.568
Molar Refractivity: 167.1±0.3 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 4
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 23.69
ACD/KOC (pH 5.5): 115.96
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 641.02
ACD/KOC (pH 7.4): 3137.81
Polar Surface Area: 193 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 55.7±3.0 dyne/cm
Molar Volume: 511.1±3.0 cm3

Click to predict properties on the Chemicalize site


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