ChemSpider 2D Image | N~5~-(Diaminomethylene)-N-{(1Z)-1-hydroxy-3-methyl-1-[(Z)-(1,1,5,5-tetrahydroxy-4-penten-2-ylidene)amino]-1-buten-2-yl}ornithinamide | C16H30N6O6

N5-(Diaminomethylene)-N-{(1Z)-1-hydroxy-3-methyl-1-[(Z)-(1,1,5,5-tetrahydroxy-4-penten-2-ylidene)amino]-1-buten-2-yl}ornithinamide

  • Molecular FormulaC16H30N6O6
  • Average mass402.446 Da
  • Monoisotopic mass402.222687 Da
  • ChemSpider ID95780943

More details:

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

N5-(Diaminomethylen)-N-{(1Z)-1-hydroxy-3-methyl-1-[(Z)-(1,1,5,5-tetrahydroxy-4-penten-2-yliden)amino]-1-buten-2-yl}ornithinamid [German] [ACD/IUPAC Name]
N5-(Diaminomethylene)-N-{(1Z)-1-hydroxy-3-methyl-1-[(Z)-(1,1,5,5-tetrahydroxy-4-penten-2-ylidene)amino]-1-buten-2-yl}ornithinamide [ACD/IUPAC Name]
N5-(Diaminométhylène)-N-{(1Z)-1-hydroxy-3-méthyl-1-[(Z)-(1,1,5,5-tétrahydroxy-4-pentén-2-ylidène)amino]-1-butén-2-yl}ornithinamide [French] [ACD/IUPAC Name]
Pentanamide, 2-amino-5-[(diaminomethylene)amino]-N-[(1Z)-1-[[[(1Z)-1-(dihydroxymethyl)-4,4-dihydroxy-3-buten-1-ylidene]amino]hydroxymethylene]-2-methylpropyl]- [ACD/Index 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: 1.611
Molar Refractivity: 95.9±0.5 cm3
#H bond acceptors: 12
#H bond donors: 12
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 0.73
ACD/LogD (pH 5.5): -6.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 233 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 60.7±7.0 dyne/cm
Molar Volume: 276.5±7.0 cm3

Click to predict properties on the Chemicalize site


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