ChemSpider 2D Image | N-[(1S,2S)-2-Amino-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamide | C17H15ClFN3O2

N-[(1S,2S)-2-Amino-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamide

  • Molecular FormulaC17H15ClFN3O2
  • Average mass347.771 Da
  • Monoisotopic mass347.083679 Da
  • ChemSpider ID28640671

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Ethanediamide, N1-[(1S,2S)-2-amino-2,3-dihydro-1H-inden-1-yl]-N2-(4-chloro-3-fluorophenyl)- [ACD/Index Name]
N-[(1S,2S)-2-Amino-2,3-dihydro-1H-inden-1-yl]-N'-(4-chlor-3-fluorphenyl)ethandiamid [German] [ACD/IUPAC Name]
N-[(1S,2S)-2-Amino-2,3-dihydro-1H-inden-1-yl]-N'-(4-chloro-3-fluorophenyl)ethanediamide [ACD/IUPAC Name]
N-[(1S,2S)-2-Amino-2,3-dihydro-1H-indén-1-yl]-N'-(4-chloro-3-fluorophényl)éthanediamide [French] [ACD/IUPAC Name]
0LL

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: 1.651
Molar Refractivity: 88.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.16
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.99
ACD/LogD (pH 7.4): 1.76
ACD/BCF (pH 7.4): 8.58
ACD/KOC (pH 7.4): 100.31
Polar Surface Area: 84 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 63.1±5.0 dyne/cm
Molar Volume: 242.6±5.0 cm3

Click to predict properties on the Chemicalize site


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