ChemSpider 2D Image | MFCD02672049 | C33H36N4O3

MFCD02672049

  • Molecular FormulaC33H36N4O3
  • Average mass536.664 Da
  • Monoisotopic mass536.278748 Da
  • ChemSpider ID326459

More details:

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

3,5-Pyridinedicarboxamide, 4-[4-(acetylamino)phenyl]-N3,N5-bis(2-ethylphenyl)-1,4-dihydro-2,6-dimethyl- [ACD/Index Name]
4-(4-Acetamidophenyl)-N,N'-bis(2-ethylphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridindicarboxamid [German] [ACD/IUPAC Name]
4-(4-Acetamidophenyl)-N,N'-bis(2-ethylphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxamide [ACD/IUPAC Name]
4-(4-Acétamidophényl)-N,N'-bis(2-éthylphényl)-2,6-diméthyl-1,4-dihydro-3,5-pyridinedicarboxamide [French] [ACD/IUPAC Name]
4-[4-(ACETYLAMINO)PHENYL]-N(3),N(5)-BIS(2-ETHYLPHENYL)-2,6-DIMETHYL-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXAMIDE
MFCD02672049
4-(4-(Acetylamino)phenyl)-N3,N5-bis(2-ethylphenyl)-2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxamide

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

AIDS136363 [DBID]
AIDS-136363 [DBID]
NCI60_012519 [DBID]
NSC637673 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 802.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.7±3.0 kJ/mol
Flash Point: 211.8±34.4 °C
Index of Refraction: 1.647
Molar Refractivity: 160.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.81
ACD/LogD (pH 5.5): 5.26
ACD/BCF (pH 5.5): 5884.12
ACD/KOC (pH 5.5): 17351.04
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5912.65
ACD/KOC (pH 7.4): 17435.14
Polar Surface Area: 99 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 55.6±3.0 dyne/cm
Molar Volume: 441.1±3.0 cm3

Click to predict properties on the Chemicalize site


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