ChemSpider 2D Image | N-(Phenylsulfonyl)-6-(3-{2-[1-(trifluoromethyl)cyclopropyl]ethoxy}-1H-pyrazol-1-yl)-2-[(4S)-2,2,4-trimethyl-1-pyrrolidinyl]nicotinamide | C28H32F3N5O4S

N-(Phenylsulfonyl)-6-(3-{2-[1-(trifluoromethyl)cyclopropyl]ethoxy}-1H-pyrazol-1-yl)-2-[(4S)-2,2,4-trimethyl-1-pyrrolidinyl]nicotinamide

  • Molecular FormulaC28H32F3N5O4S
  • Average mass591.645 Da
  • Monoisotopic mass591.212708 Da
  • ChemSpider ID75531285

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

3-Pyridinecarboxamide, N-(phenylsulfonyl)-6-[3-[2-[1-(trifluoromethyl)cyclopropyl]ethoxy]-1H-pyrazol-1-yl]-2-[(4S)-2,2,4-trimethyl-1-pyrrolidinyl]- [ACD/Index Name]
N-(Phenylsulfonyl)-6-(3-{2-[1-(trifluormethyl)cyclopropyl]ethoxy}-1H-pyrazol-1-yl)-2-[(4S)-2,2,4-trimethyl-1-pyrrolidinyl]nicotinamid [German] [ACD/IUPAC Name]
N-(Phenylsulfonyl)-6-(3-{2-[1-(trifluoromethyl)cyclopropyl]ethoxy}-1H-pyrazol-1-yl)-2-[(4S)-2,2,4-trimethyl-1-pyrrolidinyl]nicotinamide [ACD/IUPAC Name]
N-(Phénylsulfonyl)-6-(3-{2-[1-(trifluorométhyl)cyclopropyl]éthoxy}-1H-pyrazol-1-yl)-2-[(4S)-2,2,4-triméthyl-1-pyrrolidinyl]nicotinamide [French] [ACD/IUPAC Name]
2204245-48-5 [RN]
Bamocaftor
N-(benzenesulfonyl)-6-[3-[2-[1-(trifluoromethyl)cyclopropyl]ethoxy]pyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide
Vx-659

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: 1.622
Molar Refractivity: 148.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.71
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 86.63
ACD/KOC (pH 5.5): 342.39
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 21.95
ACD/KOC (pH 7.4): 86.75
Polar Surface Area: 115 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 49.2±7.0 dyne/cm
Molar Volume: 421.9±7.0 cm3

Click to predict properties on the Chemicalize site


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