ChemSpider 2D Image | Nalpha-{[(2R)-1-(Cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide | C24H33N5O5S

Nα-{[(2R)-1-(Cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide

  • Molecular FormulaC24H33N5O5S
  • Average mass503.614 Da
  • Monoisotopic mass503.220245 Da
  • ChemSpider ID5503406

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1H-Indole-3-propanamide, α-[[[(2R)-1-(cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl]amino]-, (αR)- [ACD/Index Name]
Nα-{[(2R)-1-(Cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamid [German] [ACD/IUPAC Name]
Nα-{[(2R)-1-(Cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide [ACD/IUPAC Name]
Nα-{[(2R)-1-(Cyclohexylcarbonyl)-4-(méthylsulfonyl)-2-pipérazinyl]carbonyl}-D-tryptophaneamide [French] [ACD/IUPAC Name]

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

ZINC04277968 [DBID]

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: 1.652
Molar Refractivity: 132.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.97
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.72
ACD/KOC (pH 5.5): 105.71
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 4.72
ACD/KOC (pH 7.4): 105.71
Polar Surface Area: 154 Å2
Polarizability: 52.5±0.5 10-24cm3
Surface Tension: 71.2±5.0 dyne/cm
Molar Volume: 362.1±5.0 cm3

Click to predict properties on the Chemicalize site


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