ChemSpider 2D Image | 3'-Azido-5'-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-3'-deoxythymidine | C31H37N6O7

3'-Azido-5'-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-3'-deoxythymidine

  • Molecular FormulaC31H37N6O7
  • Average mass604.654 Da
  • Monoisotopic mass604.264526 Da
  • ChemSpider ID2338942

  • defined stereocentres - 8 of 11 defined stereocentres

More details:

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

3'-Azido-5'-O-[(16-cyan-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-3'-desoxythymidin [German] [ACD/IUPAC Name]
3'-Azido-5'-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-3'-deoxythymidine [ACD/IUPAC Name]
3'-Azido-5'-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dién-17-yl)carbonyl]-3'-désoxythymidine [French] [ACD/IUPAC Name]
Thymidine, 3'-azido-5'-O-[(16-cyano-11-hydroxy-3-oxoandrosta-1,4-dien-17-yl)carbonyl]-3'-deoxy- [ACD/Index Name]
148335-29-9 [RN]
3'-Azido-3'-deoxy-5'-O-((16-cyano-11-hydroxy-3-oxo-17-androsta-1,4-dienyl)carbonyl)thymidine
Androst-1,4-diene-17-carboxylic acid, 16-cyano-11-hydroxy-3-oxo-, 5'-ester with 3'-azido-3'-deoxythymidine, (11β,16β,17β)-
CHOAD-AZT

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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