Found 28 results

Search term: MF = 'C_{38}H_{36}N_{4}O_{3}'
ChemSpider 2D Image | (2E)-N-{2-(6-Oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)-5-[(4-phenyl-3,6-dihydro-1(2H)-pyridinyl)carbonyl]phenyl}-3-phenylacrylamide | C38H36N4O3

(2E)-N-{2-(6-Oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)-5-[(4-phenyl-3,6-dihydro-1(2H)-pyridinyl)carbonyl]phenyl}-3-phenylacrylamide

  • Molecular FormulaC38H36N4O3
  • Average mass596.717 Da
  • Monoisotopic mass596.278748 Da
  • ChemSpider ID23016211

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-{2-(6-Oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)-5-[(4-phenyl-3,6-dihydro-1(2H)-pyridinyl)carbonyl]phenyl}-3-phenylacrylamid [German] [ACD/IUPAC Name]
(2E)-N-{2-(6-Oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)-5-[(4-phenyl-3,6-dihydro-1(2H)-pyridinyl)carbonyl]phenyl}-3-phenylacrylamide [ACD/IUPAC Name]
(2E)-N-{2-(6-Oxo-7,11-diazatricyclo[7.3.1.02,7]tridéca-2,4-dién-11-yl)-5-[(4-phényl-3,6-dihydro-1(2H)-pyridinyl)carbonyl]phényl}-3-phénylacrylamide [French] [ACD/IUPAC Name]
2-Propenamide, N-[5-[(3,6-dihydro-4-phenyl-1(2H)-pyridinyl)carbonyl]-2-(1,5,6,8-tetrahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-3(4H)-yl)phenyl]-3-phenyl-, (2E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 902.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.3±3.0 kJ/mol
Flash Point: 499.7±34.3 °C
Index of Refraction: 1.712
Molar Refractivity: 175.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.34
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1322.42
ACD/KOC (pH 5.5): 5948.36
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1338.13
ACD/KOC (pH 7.4): 6019.05
Polar Surface Area: 73 Å2
Polarizability: 69.5±0.5 10-24cm3
Surface Tension: 69.3±5.0 dyne/cm
Molar Volume: 448.1±5.0 cm3

Click to predict properties on the Chemicalize site


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