ChemSpider 2D Image | N-Ethyl-3-[(4-methoxybenzoyl)amino]-N-(3-methylphenyl)-4-(6-oxo-7,11-diazatricyclo[7.3.1.0~2,7~]trideca-2,4-dien-11-yl)benzamide | C35H36N4O4

N-Ethyl-3-[(4-methoxybenzoyl)amino]-N-(3-methylphenyl)-4-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)benzamide

  • Molecular FormulaC35H36N4O4
  • Average mass576.685 Da
  • Monoisotopic mass576.273682 Da
  • ChemSpider ID4191833

More details:

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

Benzamide, N-ethyl-3-[(4-methoxybenzoyl)amino]-N-(3-methylphenyl)-4-(1,5,6,8-tetrahydro-8-oxo-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-3(4H)-yl)- [ACD/Index Name]
N-Ethyl-3-[(4-methoxybenzoyl)amino]-N-(3-methylphenyl)-4-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)benzamid [German] [ACD/IUPAC Name]
N-Ethyl-3-[(4-methoxybenzoyl)amino]-N-(3-methylphenyl)-4-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)benzamide [ACD/IUPAC Name]
N-Éthyl-3-[(4-méthoxybenzoyl)amino]-N-(3-méthylphényl)-4-(6-oxo-7,11-diazatricyclo[7.3.1.02,7]tridéca-2,4-dién-11-yl)benzamide [French] [ACD/IUPAC Name]

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

CDS1_002335 [DBID]
ChemDiv1_015071 [DBID]
DivK1c_003375 [DBID]
EU-0095650 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 767.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.8±3.0 kJ/mol
Flash Point: 418.0±32.9 °C
Index of Refraction: 1.682
Molar Refractivity: 165.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 4.23
ACD/BCF (pH 5.5): 967.66
ACD/KOC (pH 5.5): 4772.70
ACD/LogD (pH 7.4): 4.23
ACD/BCF (pH 7.4): 967.80
ACD/KOC (pH 7.4): 4773.37
Polar Surface Area: 82 Å2
Polarizability: 65.7±0.5 10-24cm3
Surface Tension: 66.2±5.0 dyne/cm
Molar Volume: 437.3±5.0 cm3

Click to predict properties on the Chemicalize site


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