Found 23 results

Search term: MF = 'C_{28}H_{34}F_{2}N_{4}O_{4}'
ChemSpider 2D Image | Methyl (2R)-2-cyclopropyl-2-({[5-(2,4-difluorophenoxy)-1-isobutyl-1H-indazol-6-yl]carbonyl}amino)-4-(dimethylamino)butanoate | C28H34F2N4O4

Methyl (2R)-2-cyclopropyl-2-({[5-(2,4-difluorophenoxy)-1-isobutyl-1H-indazol-6-yl]carbonyl}amino)-4-(dimethylamino)butanoate

  • Molecular FormulaC28H34F2N4O4
  • Average mass528.591 Da
  • Monoisotopic mass528.254822 Da
  • ChemSpider ID10139909

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-Cyclopropyl-2-({[5-(2,4-difluorophénoxy)-1-isobutyl-1H-indazol-6-yl]carbonyl}amino)-4-(diméthylamino)butanoate de méthyle [French] [ACD/IUPAC Name]
Cyclopropaneacetic acid, α-[[[5-(2,4-difluorophenoxy)-1-(2-methylpropyl)-1H-indazol-6-yl]carbonyl]amino]-α-[2-(dimethylamino)ethyl]-, methyl ester, (αR)- [ACD/Index Name]
Methyl (2R)-2-cyclopropyl-2-({[5-(2,4-difluorophenoxy)-1-isobutyl-1H-indazol-6-yl]carbonyl}amino)-4-(dimethylamino)butanoate [ACD/IUPAC Name]
Methyl-(2R)-2-cyclopropyl-2-({[5-(2,4-difluorphenoxy)-1-isobutyl-1H-indazol-6-yl]carbonyl}amino)-4-(dimethylamino)butanoat [German] [ACD/IUPAC 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: 633.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.6±3.0 kJ/mol
Flash Point: 336.6±31.5 °C
Index of Refraction: 1.588
Molar Refractivity: 139.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 2.11
ACD/BCF (pH 5.5): 4.57
ACD/KOC (pH 5.5): 14.69
ACD/LogD (pH 7.4): 3.40
ACD/BCF (pH 7.4): 89.86
ACD/KOC (pH 7.4): 289.24
Polar Surface Area: 86 Å2
Polarizability: 55.2±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 414.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement