ChemSpider 2D Image | Abeprazan | C19H17F3N2O3S

Abeprazan

  • Molecular FormulaC19H17F3N2O3S
  • Average mass410.410 Da
  • Monoisotopic mass410.091187 Da
  • ChemSpider ID68006985

More details:

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

1-{5-(2,4-Difluorophenyl)-1-[(3-fluorophenyl)sulfonyl]-4-methoxy-1H-pyrrol-3-yl}-N-methylmethanamine [ACD/IUPAC Name]
1-{5-(2,4-Difluorophényl)-1-[(3-fluorophényl)sulfonyl]-4-méthoxy-1H-pyrrol-3-yl}-N-méthylméthanamine [French] [ACD/IUPAC Name]
1-{5-(2,4-Difluorphenyl)-1-[(3-fluorphenyl)sulfonyl]-4-methoxy-1H-pyrrol-3-yl}-N-methylmethanamin [German] [ACD/IUPAC Name]
1H-Pyrrole-3-methanamine, 5-(2,4-difluorophenyl)-1-[(3-fluorophenyl)sulfonyl]-4-methoxy-N-methyl- [ACD/Index Name]
Abeprazan
1-[5-(2,4-difluorophenyl)-1-(3-fluorophenyl)sulfonyl-4-methoxypyrrol-3-yl]-N-methylmethanamine
1902954-60-2 [RN]
BE52S2C1QT

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

Density: 1.4±0.1 g/cm3
Boiling Point: 497.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.9±31.5 °C
Index of Refraction: 1.575
Molar Refractivity: 99.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.07
ACD/LogD (pH 7.4): 2.27
ACD/BCF (pH 7.4): 17.52
ACD/KOC (pH 7.4): 135.99
Polar Surface Area: 69 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 40.8±7.0 dyne/cm
Molar Volume: 302.0±7.0 cm3

Click to predict properties on the Chemicalize site


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