Found 246 results

Search term: MF = 'C_{21}H_{32}N_{4}O_{7}'
ChemSpider 2D Image | Ethyl 4-({3-[(3,4,5-trimethoxybenzoyl)amino]propyl}carbamoyl)-1-piperazinecarboxylate | C21H32N4O7

Ethyl 4-({3-[(3,4,5-trimethoxybenzoyl)amino]propyl}carbamoyl)-1-piperazinecarboxylate

  • Molecular FormulaC21H32N4O7
  • Average mass452.501 Da
  • Monoisotopic mass452.227112 Da
  • ChemSpider ID59593408

More details:

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

1-Piperazinecarboxylic acid, 4-[[[3-[(3,4,5-trimethoxybenzoyl)amino]propyl]amino]carbonyl]-, ethyl ester [ACD/Index Name]
4-({3-[(3,4,5-Triméthoxybenzoyl)amino]propyl}carbamoyl)-1-pipérazinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-({3-[(3,4,5-trimethoxybenzoyl)amino]propyl}carbamoyl)-1-piperazinecarboxylate [ACD/IUPAC Name]
Ethyl-4-({3-[(3,4,5-trimethoxybenzoyl)amino]propyl}carbamoyl)-1-piperazincarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 635.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.4±31.5 °C
Index of Refraction: 1.538
Molar Refractivity: 116.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.02
ACD/LogD (pH 5.5): 0.51
ACD/BCF (pH 5.5): 1.45
ACD/KOC (pH 5.5): 45.43
ACD/LogD (pH 7.4): 0.51
ACD/BCF (pH 7.4): 1.45
ACD/KOC (pH 7.4): 45.43
Polar Surface Area: 119 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 372.5±3.0 cm3

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