Found 43 results

Search term: MF = 'C_{28}H_{32}N_{6}O_{6}S'
ChemSpider 2D Image | N-[(5E)-5-{4-[4-({2-Hydroxy-3-[(2-oxo-2,3-dihydro-1H-benzimidazol-4-yl)oxy]propyl}amino)-1-piperidinyl]benzylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]-beta-alanine | C28H32N6O6S

N-[(5E)-5-{4-[4-({2-Hydroxy-3-[(2-oxo-2,3-dihydro-1H-benzimidazol-4-yl)oxy]propyl}amino)-1-piperidinyl]benzylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]-β-alanine

  • Molecular FormulaC28H32N6O6S
  • Average mass580.655 Da
  • Monoisotopic mass580.210388 Da
  • ChemSpider ID8342612

  • Double-bond stereo - Double-bond stereo

More details:

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

N-[(5E)-5-{4-[4-({2-Hydroxy-3-[(2-oxo-2,3-dihydro-1H-benzimidazol-4-yl)oxy]propyl}amino)-1-piperidinyl]benzyliden}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]-β-alanin [German] [ACD/IUPAC Name]
N-[(5E)-5-{4-[4-({2-Hydroxy-3-[(2-oxo-2,3-dihydro-1H-benzimidazol-4-yl)oxy]propyl}amino)-1-piperidinyl]benzylidene}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]-β-alanine [ACD/IUPAC Name]
N-[(5E)-5-{4-[4-({2-Hydroxy-3-[(2-oxo-2,3-dihydro-1H-benzimidazol-4-yl)oxy]propyl}amino)-1-pipéridinyl]benzylidène}-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]-β-alanine [French] [ACD/IUPAC Name]
β-Alanine, N-[(5E)-5-[[4-[4-[[3-[(2,3-dihydro-2-oxo-1H-benzimidazol-4-yl)oxy]-2-hydroxypropyl]amino]-1-piperidinyl]phenyl]methylene]-4,5-dihydro-4-oxo-2-thiazolyl]- [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: 1.725
Molar Refractivity: 151.5±0.5 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 1.81
ACD/LogD (pH 5.5): -0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.55
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 190 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 66.9±7.0 dyne/cm
Molar Volume: 381.7±7.0 cm3

Click to predict properties on the Chemicalize site


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