ChemSpider 2D Image | WAY-267,464 | C32H35N7O4

WAY-267,464

  • Molecular FormulaC32H35N7O4
  • Average mass581.665 Da
  • Monoisotopic mass581.275024 Da
  • ChemSpider ID31047382

More details:






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

1-Piperazinecarboxamide, N-[[4-[(4,10-dihydro-1-methylpyrazolo[3,4-b][1,5]benzodiazepin-5(1H)-yl)carbonyl]-2-methylphenyl]methyl]-4-[(3,5-dihydroxyphenyl)methyl]- [ACD/Index Name]
4-(3,5-Dihydroxybenzyl)-N-{2-methyl-4-[(1-methyl-4,10-dihydropyrazolo[3,4-b][1,5]benzodiazepin-5(1H)-yl)carbonyl]benzyl}-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-(3,5-Dihydroxybenzyl)-N-{2-methyl-4-[(1-methyl-4,10-dihydropyrazolo[3,4-b][1,5]benzodiazepin-5(1H)-yl)carbonyl]benzyl}-1-piperazinecarboxamide [ACD/IUPAC Name]
4-(3,5-Dihydroxybenzyl)-N-{2-méthyl-4-[(1-méthyl-4,10-dihydropyrazolo[3,4-b][1,5]benzodiazépin-5(1H)-yl)carbonyl]benzyl}-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]
847375-16-0 [RN]
WAY-267,464 [Wiki]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 900.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.3±3.0 kJ/mol
Flash Point: 498.2±34.3 °C
Index of Refraction: 1.702
Molar Refractivity: 162.8±0.5 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 2.30
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 8.05
ACD/KOC (pH 5.5): 94.27
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.19
ACD/KOC (pH 7.4): 505.83
Polar Surface Area: 126 Å2
Polarizability: 64.5±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 420.3±7.0 cm3

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