ChemSpider 2D Image | N-(trans-3-{5-[(1R)-1-Hydroxyethyl]-1,3,4-oxadiazol-2-yl}cyclobutyl)-3-phenyl-1,2-oxazole-5-carboxamide | C18H18N4O4

N-(trans-3-{5-[(1R)-1-Hydroxyethyl]-1,3,4-oxadiazol-2-yl}cyclobutyl)-3-phenyl-1,2-oxazole-5-carboxamide

  • Molecular FormulaC18H18N4O4
  • Average mass354.360 Da
  • Monoisotopic mass354.132813 Da
  • ChemSpider ID72380096

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

5-Isoxazolecarboxamide, N-[trans-3-[5-[(1R)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]cyclobutyl]-3-phenyl- [ACD/Index Name]
N-(trans-3-{5-[(1R)-1-Hydroxyethyl]-1,3,4-oxadiazol-2-yl}cyclobutyl)-3-phenyl-1,2-oxazol-5-carboxamid [German] [ACD/IUPAC Name]
N-(trans-3-{5-[(1R)-1-Hydroxyethyl]-1,3,4-oxadiazol-2-yl}cyclobutyl)-3-phenyl-1,2-oxazole-5-carboxamide [ACD/IUPAC Name]
N-(trans-3-{5-[(1R)-1-Hydroxyéthyl]-1,3,4-oxadiazol-2-yl}cyclobutyl)-3-phényl-1,2-oxazole-5-carboxamide [French] [ACD/IUPAC Name]
1953130-87-4 [RN]
N-[3-[5-[(1R)-1-hydroxyethyl]-1,3,4-oxadiazol-2-yl]cyclobutyl]-3-phenyl-1,2-oxazole-5-carboxamide
Nesolicaftor
PTI-428

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.636
Molar Refractivity: 90.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.35
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.23
ACD/KOC (pH 5.5): 40.45
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.23
ACD/KOC (pH 7.4): 40.45
Polar Surface Area: 114 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 75.0±5.0 dyne/cm
Molar Volume: 251.5±5.0 cm3

Click to predict properties on the Chemicalize site


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