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Search term: SHTLBAYLLAIJDF (Found by InChIKey (skeleton match))

ChemSpider 2D Image | N-[2-(Bis{2-[(2,3-dihydroxybenzoyl)amino]ethyl}amino)ethyl]-1-hydroxy-6-oxo-1,6-dihydro-2-pyridinecarboxamide | C26H29N5O9

N-[2-(Bis{2-[(2,3-dihydroxybenzoyl)amino]ethyl}amino)ethyl]-1-hydroxy-6-oxo-1,6-dihydro-2-pyridinecarboxamide

  • Molecular FormulaC26H29N5O9
  • Average mass555.537 Da
  • Monoisotopic mass555.196533 Da
  • ChemSpider ID25061209

More details:






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

2-Pyridinecarboxamide, N-[2-[bis[2-[(2,3-dihydroxybenzoyl)amino]ethyl]amino]ethyl]-1,6-dihydro-1-hydroxy-6-oxo- [ACD/Index Name]
N-[2-(Bis{2-[(2,3-dihydroxybenzoyl)amino]ethyl}amino)ethyl]-1-hydroxy-6-oxo-1,6-dihydro-2-pyridincarboxamid [German] [ACD/IUPAC Name]
N-[2-(Bis{2-[(2,3-dihydroxybenzoyl)amino]ethyl}amino)ethyl]-1-hydroxy-6-oxo-1,6-dihydro-2-pyridinecarboxamide [ACD/IUPAC Name]
N-[2-(Bis{2-[(2,3-dihydroxybenzoyl)amino]éthyl}amino)éthyl]-1-hydroxy-6-oxo-1,6-dihydro-2-pyridinecarboxamide [French] [ACD/IUPAC Name]
N-{2-[bis(2-{[(2,3-Dihydroxyphenyl)carbonyl]amino}ethyl)amino]ethyl}-1-Hydroxy-6-Oxo-1,6-Dihydropyridine-2-Carboxamide
TC2

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.692
Molar Refractivity: 141.1±0.3 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -2.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 212 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 84.1±3.0 dyne/cm
Molar Volume: 368.6±3.0 cm3

Click to predict properties on the Chemicalize site






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