ChemSpider 2D Image | 2-[(6,7-Dichloro-4-quinazolinyl)amino]-1-[3-methyl-3-(4-phenyl-1-piperidinyl)-1-pyrrolidinyl]ethanone | C26H29Cl2N5O

2-[(6,7-Dichloro-4-quinazolinyl)amino]-1-[3-methyl-3-(4-phenyl-1-piperidinyl)-1-pyrrolidinyl]ethanone

  • Molecular FormulaC26H29Cl2N5O
  • Average mass498.447 Da
  • Monoisotopic mass497.174927 Da
  • ChemSpider ID24808284

More details:

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

2-[(6,7-Dichlor-4-chinazolinyl)amino]-1-[3-methyl-3-(4-phenyl-1-piperidinyl)-1-pyrrolidinyl]ethanon [German] [ACD/IUPAC Name]
2-[(6,7-Dichloro-4-quinazolinyl)amino]-1-[3-methyl-3-(4-phenyl-1-piperidinyl)-1-pyrrolidinyl]ethanone [ACD/IUPAC Name]
2-[(6,7-Dichloro-4-quinazolinyl)amino]-1-[3-méthyl-3-(4-phényl-1-pipéridinyl)-1-pyrrolidinyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 2-[(6,7-dichloro-4-quinazolinyl)amino]-1-[3-methyl-3-(4-phenyl-1-piperidinyl)-1-pyrrolidinyl]- [ACD/Index Name]
Kinome_3763

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

Density: 1.3±0.1 g/cm3
Boiling Point: 686.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.7±3.0 kJ/mol
Flash Point: 369.0±31.5 °C
Index of Refraction: 1.661
Molar Refractivity: 137.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.36
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.27
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 71.96
ACD/KOC (pH 7.4): 299.07
Polar Surface Area: 61 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 373.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement