ChemSpider 2D Image | 4-Cyclopentyl-N-[(1s,3r)-5-Oxidanyl-2-Adamantyl]-2-[[(3s)-Oxolan-3-Yl]amino]pyrimidine-5-Carboxamide | C24H34N4O3

4-Cyclopentyl-N-[(1s,3r)-5-Oxidanyl-2-Adamantyl]-2-[[(3s)-Oxolan-3-Yl]amino]pyrimidine-5-Carboxamide

  • Molecular FormulaC24H34N4O3
  • Average mass426.552 Da
  • Monoisotopic mass426.263092 Da
  • ChemSpider ID35036027

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

4-Cyclopentyl-N-[(1R,2s,3S,5s,7s)-5-hydroxyadamantan-2-yl]-2-[(3S)-tetrahydro-3-furanylamino]-5-pyrimidincarboxamid [German] [ACD/IUPAC Name]
4-Cyclopentyl-N-[(1R,2s,3S,5s,7s)-5-hydroxyadamantan-2-yl]-2-[(3S)-tetrahydro-3-furanylamino]-5-pyrimidinecarboxamide [ACD/IUPAC Name]
4-Cyclopentyl-N-[(1R,2s,3S,5s,7s)-5-hydroxyadamantan-2-yl]-2-[(3S)-tétrahydro-3-furanylamino]-5-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
4-Cyclopentyl-N-[(1s,3r)-5-Oxidanyl-2-Adamantyl]-2-[[(3s)-Oxolan-3-Yl]amino]pyrimidine-5-Carboxamide
5-Pyrimidinecarboxamide, 4-cyclopentyl-N-[(1R,3S)-5-hydroxytricyclo[3.3.1.13,7]dec-2-yl]-2-[[(3S)-tetrahydro-3-furanyl]amino]- [ACD/Index Name]
HD2

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: 1.624
Molar Refractivity: 115.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 33.02
ACD/KOC (pH 5.5): 425.32
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 33.04
ACD/KOC (pH 7.4): 425.58
Polar Surface Area: 96 Å2
Polarizability: 45.7±0.5 10-24cm3
Surface Tension: 65.1±5.0 dyne/cm
Molar Volume: 326.8±5.0 cm3

Click to predict properties on the Chemicalize site


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