ChemSpider 2D Image | Nalpha-{4-[4-(4-Aminophenyl)-1,3-butadiyn-1-yl]benzoyl}-N-hydroxy-L-histidinamide | C23H19N5O3

Nα-{4-[4-(4-Aminophenyl)-1,3-butadiyn-1-yl]benzoyl}-N-hydroxy-L-histidinamide

  • Molecular FormulaC23H19N5O3
  • Average mass413.429 Da
  • Monoisotopic mass413.148804 Da
  • ChemSpider ID30821046

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Imidazole-4-propanamide, α-[[4-[4-(4-aminophenyl)-1,3-butadiyn-1-yl]benzoyl]amino]-N-hydroxy-, (αS)- [ACD/Index Name]
Nα-{4-[4-(4-Aminophenyl)-1,3-butadiin-1-yl]benzoyl}-N-hydroxy-L-histidinamid [German] [ACD/IUPAC Name]
Nα-{4-[4-(4-Aminophenyl)-1,3-butadiyn-1-yl]benzoyl}-N-hydroxy-L-histidinamide [ACD/IUPAC Name]
Nα-{4-[4-(4-Aminophényl)-1,3-butadiyn-1-yl]benzoyl}-N-hydroxy-L-histidinamide [French] [ACD/IUPAC Name]
Nα-{4-[4-(4-Aminophenyl)buta-1,3-Diyn-1-Yl]benzoyl}-N-Hydroxy-L-Histidinamide
1WL

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: 1.716
Molar Refractivity: 113.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 1.82
ACD/LogD (pH 5.5): -0.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.69
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 5.49
ACD/KOC (pH 7.4): 105.46
Polar Surface Area: 133 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 90.7±5.0 dyne/cm
Molar Volume: 288.8±5.0 cm3

Click to predict properties on the Chemicalize site


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