Found 169 results

Search term: MF = 'C_{28}H_{25}ClF_{2}N_{2}O_{3}'
ChemSpider 2D Image | 1-(4-Chlorobenzyl)-2-{[(3,4-difluorophenyl)amino]methyl}-5-[2-(3-methylphenoxy)ethoxy]-4(1H)-pyridinone | C28H25ClF2N2O3

1-(4-Chlorobenzyl)-2-{[(3,4-difluorophenyl)amino]methyl}-5-[2-(3-methylphenoxy)ethoxy]-4(1H)-pyridinone

  • Molecular FormulaC28H25ClF2N2O3
  • Average mass510.960 Da
  • Monoisotopic mass510.152191 Da
  • ChemSpider ID124290758

More details:

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

1-(4-Chlorbenzyl)-2-{[(3,4-difluorphenyl)amino]methyl}-5-[2-(3-methylphenoxy)ethoxy]-4(1H)-pyridinon [German] [ACD/IUPAC Name]
1-(4-Chlorobenzyl)-2-{[(3,4-difluorophenyl)amino]methyl}-5-[2-(3-methylphenoxy)ethoxy]-4(1H)-pyridinone [ACD/IUPAC Name]
1-(4-Chlorobenzyl)-2-{[(3,4-difluorophényl)amino]méthyl}-5-[2-(3-méthylphénoxy)éthoxy]-4(1H)-pyridinone [French] [ACD/IUPAC Name]
4(1H)-Pyridinone, 1-[(4-chlorophenyl)methyl]-2-[[(3,4-difluorophenyl)amino]methyl]-5-[2-(3-methylphenoxy)ethoxy]- [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: 673.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.9±3.0 kJ/mol
Flash Point: 361.3±31.5 °C
Index of Refraction: 1.631
Molar Refractivity: 136.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.79
ACD/LogD (pH 5.5): 6.12
ACD/BCF (pH 5.5): 26279.10
ACD/KOC (pH 5.5): 50292.18
ACD/LogD (pH 7.4): 6.14
ACD/BCF (pH 7.4): 27055.81
ACD/KOC (pH 7.4): 51778.61
Polar Surface Area: 51 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 55.1±5.0 dyne/cm
Molar Volume: 381.9±5.0 cm3

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