Found 1 result

Search term: 1316643-57-8 (Found by synonym)
ChemSpider 2D Image | Allyl 4-[1b-(4-fluorophenyl)-7-hydroxy-7-isopropyl-1a-phenyl-7a-(phenylcarbamoyl)hexahydro-3H-oxireno[3,4]pyrrolo[2,1-b][1,3]oxazin-3-yl]-3-hydroxybutanoate | C36H39FN2O7

Allyl 4-[1b-(4-fluorophenyl)-7-hydroxy-7-isopropyl-1a-phenyl-7a-(phenylcarbamoyl)hexahydro-3H-oxireno[3,4]pyrrolo[2,1-b][1,3]oxazin-3-yl]-3-hydroxybutanoate

  • Molecular FormulaC36H39FN2O7
  • Average mass630.703 Da
  • Monoisotopic mass630.274109 Da
  • ChemSpider ID35467359

More details:

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

3H-Oxireno[3,4]pyrrolo[2,1-b][1,3]oxazine-3-butanoic acid, 1b-(4-fluorophenyl)hexahydro-β,7-dihydroxy-7-(1-methylethyl)-1a-phenyl-7a-[(phenylamino)carbonyl]-, 2-propen-1-yl ester [ACD/Index Name]
4-[1b-(4-Fluorophényl)-7-hydroxy-7-isopropyl-1a-phényl-7a-(phénylcarbamoyl)hexahydro-3H-oxiréno[3,4]pyrrolo[2,1-b][1,3]oxazin-3-yl]-3-hydroxybutanoate d'allyle [French] [ACD/IUPAC Name]
Allyl 4-[1b-(4-fluorophenyl)-7-hydroxy-7-isopropyl-1a-phenyl-7a-(phenylcarbamoyl)hexahydro-3H-oxireno[3,4]pyrrolo[2,1-b][1,3]oxazin-3-yl]-3-hydroxybutanoate [ACD/IUPAC Name]
Allyl-4-[1b-(4-fluorphenyl)-7-hydroxy-7-isopropyl-1a-phenyl-7a-(phenylcarbamoyl)hexahydro-3H-oxireno[3,4]pyrrolo[2,1-b][1,3]oxazin-3-yl]-3-hydroxybutanoat [German] [ACD/IUPAC Name]
1316643-57-8 [RN]
Allyl-ATV-cycloFP
Prop-2-en-1-yl 4-[1b-(4-fluorophenyl)-7-hydroxy-1a-phenyl-7a-(phenylcarbamoyl)-7-(propan-2-yl)hexahydro-3H-oxireno[3,4]pyrrolo[2,1-b][1,3]oxazin-3-yl]-3-hydroxybutanoate
prop-2-enyl 4-[1b-(4-fluorophenyl)-7-hydroxy-1a-phenyl-7a-(phenylcarbamoyl)-7-propan-2-yl-4,5-dihydro-3H-oxireno[1,2]pyrrolo[3,5-b][1,3]oxazin-3-yl]-3-hydroxybutanoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 784.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.8±3.0 kJ/mol
Flash Point: 428.5±32.9 °C
Index of Refraction: 1.644
Molar Refractivity: 169.3±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 8.14
ACD/LogD (pH 5.5): 5.78
ACD/BCF (pH 5.5): 14633.56
ACD/KOC (pH 5.5): 33353.61
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 7.4): 14633.37
ACD/KOC (pH 7.4): 33353.17
Polar Surface Area: 121 Å2
Polarizability: 67.1±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 467.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement