ChemSpider 2D Image | 1-{3-Azido-5-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-2,3-dideoxypentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione | C31H36N6O7

1-{3-Azido-5-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-2,3-dideoxypentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione

  • Molecular FormulaC31H36N6O7
  • Average mass604.654 Da
  • Monoisotopic mass604.264526 Da
  • ChemSpider ID437497

More details:






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

1-{3-Azido-5-O-[(16-cyan-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-2,3-didesoxypentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidindion [German] [ACD/IUPAC Name]
1-{3-Azido-5-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-2,3-dideoxypentofuranosyl}-5-methyl-2,4(1H,3H)-pyrimidinedione [ACD/IUPAC Name]
1-{3-Azido-5-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dién-17-yl)carbonyl]-2,3-didésoxypentofuranosyl}-5-méthyl-2,4(1H,3H)-pyrimidinedione [French] [ACD/IUPAC Name]
2,4(1H,3H)-Pyrimidinedione, 1-[3-azido-5-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-2,3-dideoxypentofuranosyl]-5-methyl- [ACD/Index Name]
{3'-Azido-2',3'-dideoxy-5'-O-[(16-cyano-11-hydroxy-3-oxo-17-} androsta-1,4-dieno)carbonyl\]thymididne

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

AIDS160631 [DBID]
AIDS-160631 [DBID]
NSC641039 [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 12.00
ACD/KOC (pH 5.5): 206.09
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 11.92
ACD/KOC (pH 7.4): 204.68
Polar Surface Area: 158 Å2
Polarizability:
Surface Tension:
Molar Volume:

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