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Search term: VOBJKTXVNRAUOO (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 3-({3-[4-(4-acetylphenyl)-1-piperazinyl]propyl}carbamoyl)-4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate | C29H33F2N5O5

Methyl 3-({3-[4-(4-acetylphenyl)-1-piperazinyl]propyl}carbamoyl)-4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

  • Molecular FormulaC29H33F2N5O5
  • Average mass569.600 Da
  • Monoisotopic mass569.244995 Da
  • ChemSpider ID9016077

More details:

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

3-({3-[4-(4-Acétylphényl)-1-pipérazinyl]propyl}carbamoyl)-4-(3,4-difluorophényl)-6-méthyl-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinecarboxylate de méthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 1-[[[3-[4-(4-acetylphenyl)-1-piperazinyl]propyl]amino]carbonyl]-6-(3,4-difluorophenyl)-1,2,3,6-tetrahydro-4-methyl-2-oxo-, methyl ester [ACD/Index Name]
Methyl 3-({3-[4-(4-acetylphenyl)-1-piperazinyl]propyl}carbamoyl)-4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate [ACD/IUPAC Name]
methyl 3-({3-[4-(4-acetylphenyl)piperazin-1-yl]propyl}carbamoyl)-4-(3,4-difluorophenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Methyl-3-({3-[4-(4-acetylphenyl)-1-piperazinyl]propyl}carbamoyl)-4-(3,4-difluorphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
3-{3-[4-(4-Acetyl-phenyl)-piperazin-1-yl]-propylcarbamoyl}-4-(3,4-difluoro-phenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid methyl ester
CHEMBL145122

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.570
Molar Refractivity: 145.3±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 7.80
ACD/KOC (pH 5.5): 58.59
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 162.91
ACD/KOC (pH 7.4): 1224.13
Polar Surface Area: 111 Å2
Polarizability: 57.6±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 442.9±3.0 cm3

Click to predict properties on the Chemicalize site


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