Found 44 results

Search term: MF = 'C_{29}H_{30}BrN_{3}O_{4}S'
ChemSpider 2D Image | Ethyl (2Z)-5-(5-bromo-2-methoxyphenyl)-7-methyl-2-[2-methyl-4-(1-pyrrolidinyl)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C29H30BrN3O4S

Ethyl (2Z)-5-(5-bromo-2-methoxyphenyl)-7-methyl-2-[2-methyl-4-(1-pyrrolidinyl)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC29H30BrN3O4S
  • Average mass596.535 Da
  • Monoisotopic mass595.114014 Da
  • ChemSpider ID79584655

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-5-(5-Bromo-2-méthoxyphényl)-7-méthyl-2-[2-méthyl-4-(1-pyrrolidinyl)benzylidène]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate d'éthyle [French] [ACD/IUPAC Name]
5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-(5-bromo-2-methoxyphenyl)-2,3-dihydro-7-methyl-2-[[2-methyl-4-(1-pyrrolidinyl)phenyl]methylene]-3-oxo-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-5-(5-bromo-2-methoxyphenyl)-7-methyl-2-[2-methyl-4-(1-pyrrolidinyl)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Ethyl-(2Z)-5-(5-brom-2-methoxyphenyl)-7-methyl-2-[2-methyl-4-(1-pyrrolidinyl)benzyliden]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 701.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 377.8±35.7 °C
Index of Refraction: 1.665
Molar Refractivity: 153.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.55
ACD/LogD (pH 5.5): 5.75
ACD/BCF (pH 5.5): 13723.67
ACD/KOC (pH 5.5): 31667.49
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 14009.31
ACD/KOC (pH 7.4): 32326.61
Polar Surface Area: 97 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 50.2±7.0 dyne/cm
Molar Volume: 413.6±7.0 cm3

Click to predict properties on the Chemicalize site


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