ChemSpider 2D Image | (1R)-1,4-Anhydro-5-O-[bis(4-methoxyphenyl)(phenyl)methyl]-2-deoxy-1-(2-{(E)-[(dimethylamino)methylene]amino}-4-oxo-1,4-dihydro-5-pyrimidinyl)-D-erythro-pentitol | C33H36N4O6

(1R)-1,4-Anhydro-5-O-[bis(4-methoxyphenyl)(phenyl)methyl]-2-deoxy-1-(2-{(E)-[(dimethylamino)methylene]amino}-4-oxo-1,4-dihydro-5-pyrimidinyl)-D-erythro-pentitol

  • Molecular FormulaC33H36N4O6
  • Average mass584.662 Da
  • Monoisotopic mass584.263489 Da
  • ChemSpider ID22937994

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R)-1,4-Anhydro-5-O-[bis(4-methoxyphenyl)(phenyl)methyl]-2-deoxy-1-(2-{(E)-[(dimethylamino)methylene]amino}-4-oxo-1,4-dihydro-5-pyrimidinyl)-D-erythro-pentitol [ACD/IUPAC Name]
(1R)-1,4-Anhydro-5-O-[bis(4-methoxyphenyl)(phenyl)methyl]-2-desoxy-1-(2-{(E)-[(dimethylamino)methylen]amino}-4-oxo-1,4-dihydro-5-pyrimidinyl)-D-erythro-pentitol [German] [ACD/IUPAC Name]
(1R)-1,4-Anhydro-5-O-[bis(4-méthoxyphényl)(phényl)méthyl]-2-désoxy-1-(2-{(E)-[(diméthylamino)méthylène]amino}-4-oxo-1,4-dihydro-5-pyrimidinyl)-D-érythro-pentitol [French] [ACD/IUPAC Name]
307314-30-3 [RN]
D-erythro-Pentitol, 1,4-anhydro-5-O-[bis(4-methoxyphenyl)phenylmethyl]-2-deoxy-1-C-[2-[[(1E)-(dimethylamino)methylene]amino]-1,6-dihydro-6-oxo-5-pyrimidinyl]-, (1R)- [ACD/Index Name]
5'-O-(DIMETHOXYTRITYL)-N-(DIMETHYLAMINO)METHYLIDENE-2'-DEOXYPSEUDOISOCYTIDINE
N'-[5-[(2R,4S,5R)-5-[[Bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-6-oxo-1H-pyrimidin-2-yl]-N,N-dimethylmethanimidamide

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: 1.610
Molar Refractivity: 162.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 756.52
ACD/KOC (pH 5.5): 3996.85
ACD/LogD (pH 7.4): 4.04
ACD/BCF (pH 7.4): 674.37
ACD/KOC (pH 7.4): 3562.83
Polar Surface Area: 114 Å2
Polarizability: 64.2±0.5 10-24cm3
Surface Tension: 46.5±7.0 dyne/cm
Molar Volume: 467.6±7.0 cm3

Click to predict properties on the Chemicalize site


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