ChemSpider 2D Image | N-{5-[(Diaminomethylene)amino]-1,1-dihydroxy-1-penten-2-yl}-1-[(2E)-1-hydroxy-2-({(Z)-hydroxy[1-(1-hydroxy-2-iminopropyl)-2-pyrrolidinylidene]methyl}imino)ethyl]prolinamide | C21H36N8O6

N-{5-[(Diaminomethylene)amino]-1,1-dihydroxy-1-penten-2-yl}-1-[(2E)-1-hydroxy-2-({(Z)-hydroxy[1-(1-hydroxy-2-iminopropyl)-2-pyrrolidinylidene]methyl}imino)ethyl]prolinamide

  • Molecular FormulaC21H36N8O6
  • Average mass496.560 Da
  • Monoisotopic mass496.275787 Da
  • ChemSpider ID95641767

  • Double-bond stereo - Double-bond stereo

More details:

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

2-Pyrrolidinecarboxamide, N-[4-[(diaminomethylene)amino]-1-(dihydroxymethylene)butyl]-1-[(2E)-1-hydroxy-2-[[(Z)-hydroxy[1-(1-hydroxy-2-iminopropyl)-2-pyrrolidinylidene]methyl]imino]ethyl]- [ACD/Index Name]
N-{5-[(Diaminomethylen)amino]-1,1-dihydroxy-1-penten-2-yl}-1-[(2E)-1-hydroxy-2-({(Z)-hydroxy[1-(1-hydroxy-2-iminopropyl)-2-pyrrolidinyliden]methyl}imino)ethyl]prolinamid [German] [ACD/IUPAC Name]
N-{5-[(Diaminomethylene)amino]-1,1-dihydroxy-1-penten-2-yl}-1-[(2E)-1-hydroxy-2-({(Z)-hydroxy[1-(1-hydroxy-2-iminopropyl)-2-pyrrolidinylidene]methyl}imino)ethyl]prolinamide [ACD/IUPAC Name]
N-{5-[(Diaminométhylène)amino]-1,1-dihydroxy-1-pentén-2-yl}-1-[(2E)-1-hydroxy-2-({(Z)-hydroxy[1-(1-hydroxy-2-iminopropyl)-2-pyrrolidinylidène]méthyl}imino)éthyl]prolinamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.682
Molar Refractivity: 122.0±0.5 cm3
#H bond acceptors: 14
#H bond donors: 11
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.89
ACD/LogD (pH 5.5): -4.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 237 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 69.9±7.0 dyne/cm
Molar Volume: 322.1±7.0 cm3

Click to predict properties on the Chemicalize site


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