ChemSpider 2D Image | 1-[(6R,8R,9R)-4-Amino-6,9-bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-2,2-dioxido-1,7-dioxa-2-thiaspiro[4.4]non-3-en-8-yl]-3-ethyl-5-methyl-2,4(1H,3H)-pyrimidinedione | C25H45N3O8SSi2

1-[(6R,8R,9R)-4-Amino-6,9-bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-2,2-dioxido-1,7-dioxa-2-thiaspiro[4.4]non-3-en-8-yl]-3-ethyl-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC25H45N3O8SSi2
  • Average mass603.876 Da
  • Monoisotopic mass603.246582 Da
  • ChemSpider ID424087

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

1-[(6R,8R,9R)-4-Amino-6,9-bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-2,2-dioxido-1,7-dioxa-2-thiaspiro[4.4]non-3-en-8-yl]-3-ethyl-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-[(6R,8R,9R)-4-Amino-6,9-bis{[dimethyl(2-methyl-2-propanyl)silyl]oxy}-2,2-dioxido-1,7-dioxa-2-thiaspiro[4.4]non-3-en-8-yl]-3-ethyl-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-[(6R,8R,9R)-4-Amino-6,9-bis{[diméthyl(2-méthyl-2-propanyl)silyl]oxy}-2,2-dioxydo-1,7-dioxa-2-thiaspiro[4.4]non-3-én-8-yl]-3-éthyl-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[(6R,8R,9R)-4-amino-6,9-bis[[(1,1-dimethylethyl)dimethylsilyl]oxy]-2,2-dioxido-1,7-dioxa-2-thiaspiro[4.4]non-3-en-8-yl]-3-ethyl-5-methyl- [ACD/Index Name]
1-[4-Amino-6,9-bis-(tert-butyl-dimethyl-silanyloxy)-2,2-dioxo-1,7-dioxa-2λ-thia-spiro[4.4]non-3-en-8-yl]-3-ethyl-5-methyl-1H-pyrimidine-2,4-dione

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

AIDS105013 [DBID]
AIDS-105013 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 613.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 324.7±34.3 °C
Index of Refraction: 1.543
Molar Refractivity: 155.9±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 8.26
ACD/LogD (pH 5.5): 6.13
ACD/BCF (pH 5.5): 26987.30
ACD/KOC (pH 5.5): 51690.18
ACD/LogD (pH 7.4): 6.13
ACD/BCF (pH 7.4): 26987.54
ACD/KOC (pH 7.4): 51690.63
Polar Surface Area: 146 Å2
Polarizability: 61.8±0.5 10-24cm3
Surface Tension: 43.0±5.0 dyne/cm
Molar Volume: 495.0±5.0 cm3

Click to predict properties on the Chemicalize site


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