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ChemSpider 2D Image | Flovagatran | C27H36BN3O7

Flovagatran

  • Molecular FormulaC27H36BN3O7
  • Average mass525.402 Da
  • Monoisotopic mass525.264648 Da
  • ChemSpider ID8047436
  • defined stereocentres - 3 of 3 defined stereocentres


More details:






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

2WA50NUH6H
871576-03-3 [RN]
8896
flovagatran [French] [INN]
Flovagatran [INN]
flovagatrán [Spanish] [INN]
flovagatranum [Latin] [INN]
L-Prolinamide, N-[(phenylmethoxy)carbonyl]-D-phenylalanyl-N-[(1R)-1-borono-4-methoxybutyl]- [ACD/Index Name]
N-[(Benzyloxy)carbonyl]-D-phenylalanyl-N-[(1R)-1-(dihydroxyboryl)-4-methoxybutyl]-L-prolinamid [German] [ACD/IUPAC Name]
N-[(Benzyloxy)carbonyl]-D-phenylalanyl-N-[(1R)-1-(dihydroxyboryl)-4-methoxybutyl]-L-prolinamide [ACD/IUPAC Name]
More...

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.569
Molar Refractivity: 139.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 3.54
ACD/LogD (pH 5.5): 3.26
ACD/BCF (pH 5.5): 177.93
ACD/KOC (pH 5.5): 1420.11
ACD/LogD (pH 7.4): 3.26
ACD/BCF (pH 7.4): 177.28
ACD/KOC (pH 7.4): 1414.95
Polar Surface Area: 137 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 424.4±3.0 cm3

Click to predict properties on the Chemicalize site






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