ChemSpider 2D Image | 3,6-Bis(3-(3'-(R)-Fluoropyrrolindino)propionamido)acridine | C27H31F2N5O2

3,6-Bis(3-(3'-(R)-Fluoropyrrolindino)propionamido)acridine

  • Molecular FormulaC27H31F2N5O2
  • Average mass495.564 Da
  • Monoisotopic mass495.244568 Da
  • ChemSpider ID25057827
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

1-Pyrrolidinepropanamide, N,N'-3,6-acridinediylbis[3-fluoro-, (3R)- [ACD/Index Name]
3,6-Bis(3-(3'-(R)-Fluoropyrrolindino)propionamido)acridine
N,N'-3,6-Acridindiylbis{3-[(3R)-3-fluor-1-pyrrolidinyl]propanamid} [German] [ACD/IUPAC Name]
N,N'-3,6-Acridinediylbis{3-[(3R)-3-fluoro-1-pyrrolidinyl]propanamide} [ACD/IUPAC Name]
N,N'-3,6-Acridinediylbis{3-[(3R)-3-fluoro-1-pyrrolidinyl]propanamide} [French] [ACD/IUPAC Name]
RNR

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 788.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.6±3.0 kJ/mol
Flash Point: 430.4±32.9 °C
Index of Refraction: 1.650
Molar Refractivity: 135.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): -2.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 9.80
ACD/KOC (pH 7.4): 108.90
Polar Surface Area: 78 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 61.4±5.0 dyne/cm
Molar Volume: 372.5±5.0 cm3

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