ChemSpider 2D Image | N-{(3R)-4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]-3-hydroxybutyl}-1H-indole-2-carboxamide | C23H26Cl2N4O2

N-{(3R)-4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]-3-hydroxybutyl}-1H-indole-2-carboxamide

  • Molecular FormulaC23H26Cl2N4O2
  • Average mass461.384 Da
  • Monoisotopic mass460.143280 Da
  • ChemSpider ID26354096
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Indole-2-carboxamide, N-[(3R)-4-[4-(2,3-dichlorophenyl)-1-piperazinyl]-3-hydroxybutyl]- [ACD/Index Name]
N-{(3R)-4-[4-(2,3-Dichlorophenyl)-1-piperazinyl]-3-hydroxybutyl}-1H-indole-2-carboxamide [ACD/IUPAC Name]
N-{(3R)-4-[4-(2,3-Dichlorophényl)-1-pipérazinyl]-3-hydroxybutyl}-1H-indole-2-carboxamide [French] [ACD/IUPAC Name]
N-{(3R)-4-[4-(2,3-Dichlorphenyl)-1-piperazinyl]-3-hydroxybutyl}-1H-indol-2-carboxamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 741.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.5±3.0 kJ/mol
Flash Point: 402.3±32.9 °C
Index of Refraction: 1.653
Molar Refractivity: 125.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.55
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 97.44
ACD/KOC (pH 5.5): 406.08
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1439.34
ACD/KOC (pH 7.4): 5998.13
Polar Surface Area: 72 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 342.3±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement