Found 218 results

Search term: MF = 'C_{25}H_{21}F_{2}N_{3}O_{3}S'
ChemSpider 2D Image | Allyl 5-cyano-4-(2-fluorophenyl)-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydro-3-pyridinecarboxylate | C25H21F2N3O3S

Allyl 5-cyano-4-(2-fluorophenyl)-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydro-3-pyridinecarboxylate

  • Molecular FormulaC25H21F2N3O3S
  • Average mass481.514 Da
  • Monoisotopic mass481.127167 Da
  • ChemSpider ID21668860

More details:

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

3-Pyridinecarboxylic acid, 5-cyano-4-(2-fluorophenyl)-6-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]thio]-1,4-dihydro-2-methyl-, 2-propen-1-yl ester [ACD/Index Name]
5-Cyano-4-(2-fluorophényl)-6-({2-[(4-fluorophényl)amino]-2-oxoéthyl}sulfanyl)-2-méthyl-1,4-dihydro-3-pyridinecarboxylate d'allyle [French] [ACD/IUPAC Name]
Allyl 5-cyano-4-(2-fluorophenyl)-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydro-3-pyridinecarboxylate [ACD/IUPAC Name]
Allyl 5-cyano-4-(2-fluorophenyl)-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
Allyl-5-cyan-4-(2-fluorphenyl)-6-({2-[(4-fluorphenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydro-3-pyridincarboxylat [German] [ACD/IUPAC Name]
prop-2-en-1-yl 5-cyano-4-(2-fluorophenyl)-6-({[(4-fluorophenyl)carbamoyl]methyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxylate
prop-2-en-1-yl 5-cyano-4-(2-fluorophenyl)-6-({2-[(4-fluorophenyl)amino]-2-oxoethyl}sulfanyl)-2-methyl-1,4-dihydropyridine-3-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 643.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.0±3.0 kJ/mol
Flash Point: 343.2±31.5 °C
Index of Refraction: 1.623
Molar Refractivity: 125.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.78
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 2619.55
ACD/KOC (pH 5.5): 9735.55
ACD/LogD (pH 7.4): 4.80
ACD/BCF (pH 7.4): 2619.57
ACD/KOC (pH 7.4): 9735.63
Polar Surface Area: 117 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 57.2±5.0 dyne/cm
Molar Volume: 356.4±5.0 cm3

Click to predict properties on the Chemicalize site


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