ChemSpider 2D Image | N-[4-(Diethylamino)-2-methylphenyl]-Nalpha-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamide | C32H41N5O4S

N-[4-(Diethylamino)-2-methylphenyl]-Nα-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamide

  • Molecular FormulaC32H41N5O4S
  • Average mass591.764 Da
  • Monoisotopic mass591.287903 Da
  • ChemSpider ID120682166

More details:

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

Benzenepropanamide, N-[4-(diethylamino)-2-methylphenyl]-α-[[3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl]amino]- [ACD/Index Name]
N-[4-(Diethylamino)-2-methylphenyl]-Nα-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamid [German] [ACD/IUPAC Name]
N-[4-(Diethylamino)-2-methylphenyl]-Nα-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamide [ACD/IUPAC Name]
N-[4-(Diéthylamino)-2-méthylphényl]-Nα-{3-[(4-méthyl-1-pipérazinyl)sulfonyl]benzoyl}phénylalaninamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 166.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 5.13
ACD/KOC (pH 5.5): 24.31
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 563.18
ACD/KOC (pH 7.4): 2667.13
Polar Surface Area: 110 Å2
Polarizability: 66.2±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 478.5±3.0 cm3

Click to predict properties on the Chemicalize site


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