ChemSpider 2D Image | 1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-4-(4-methoxybenzoyl)-5-[3-methoxy-4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one | C30H32N2O7S

1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-4-(4-methoxybenzoyl)-5-[3-methoxy-4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC30H32N2O7S
  • Average mass564.649 Da
  • Monoisotopic mass564.192993 Da
  • ChemSpider ID12276098

More details:

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

1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-4-(4-methoxybenzoyl)-5-[3-methoxy-4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
1-(5-Acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-4-(4-methoxybenzoyl)-5-[3-methoxy-4-(pentyloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
1-(5-Acétyl-4-méthyl-1,3-thiazol-2-yl)-3-hydroxy-4-(4-méthoxybenzoyl)-5-[3-méthoxy-4-(pentyloxy)phényl]-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]
2H-Pyrrol-2-one, 1-(5-acetyl-4-methyl-2-thiazolyl)-1,5-dihydro-3-hydroxy-4-(4-methoxybenzoyl)-5-[3-methoxy-4-(pentyloxy)phenyl]- [ACD/Index Name]
1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-5-[3-methoxy-4-(pentyloxy)phenyl]-4-(4-methoxybenzoyl)-2,5-dihydro-1H-pyrrol-2-one
1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-5-[3-methoxy-4-(pentyloxy)phenyl]-4-[(4-methoxyphenyl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one
1-(5-acetyl-4-methylthiazol-2-yl)-3-hydroxy-5-(3-methoxy-4-(pentyloxy)phenyl)-4-(4-methoxybenzoyl)-1H-pyrrol-2(5H)-one
5-acetyl-2-{3-hydroxy-5-(3-methoxy-4-pentyloxyphenyl)-4-[(4-methoxyphenyl)carbonyl]-2-oxo(3-pyrrolinyl)}-4-methyl-1,3-thiazole

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

Density: 1.3±0.1 g/cm3
Boiling Point: 709.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.0±3.0 kJ/mol
Flash Point: 383.0±35.7 °C
Index of Refraction: 1.612
Molar Refractivity: 151.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 5.42
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 166.88
ACD/KOC (pH 5.5): 686.77
ACD/LogD (pH 7.4): 1.79
ACD/BCF (pH 7.4): 2.88
ACD/KOC (pH 7.4): 11.85
Polar Surface Area: 144 Å2
Polarizability: 60.2±0.5 10-24cm3
Surface Tension: 55.7±3.0 dyne/cm
Molar Volume: 436.5±3.0 cm3

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