ChemSpider 2D Image | Methyl 1-[3-({[5-carbamoyl-6-(3,4-difluorophenyl)-4-ethyl-2-oxo-3,6-dihydro-1(2H)-pyrimidinyl]carbonyl}amino)propyl]-4-phenyl-4-piperidinecarboxylate | C30H35F2N5O5

Methyl 1-[3-({[5-carbamoyl-6-(3,4-difluorophenyl)-4-ethyl-2-oxo-3,6-dihydro-1(2H)-pyrimidinyl]carbonyl}amino)propyl]-4-phenyl-4-piperidinecarboxylate

  • Molecular FormulaC30H35F2N5O5
  • Average mass583.626 Da
  • Monoisotopic mass583.260620 Da
  • ChemSpider ID8275345

More details:

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

1-[3-({[5-Carbamoyl-6-(3,4-difluorophényl)-4-éthyl-2-oxo-3,6-dihydro-1(2H)-pyrimidinyl]carbonyl}amino)propyl]-4-phényl-4-pipéridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
4-Piperidinecarboxylic acid, 1-[3-[[[5-(aminocarbonyl)-6-(3,4-difluorophenyl)-4-ethyl-3,6-dihydro-2-oxo-1(2H)-pyrimidinyl]carbonyl]amino]propyl]-4-phenyl-, methyl ester [ACD/Index Name]
Methyl 1-[3-({[5-carbamoyl-6-(3,4-difluorophenyl)-4-ethyl-2-oxo-3,6-dihydro-1(2H)-pyrimidinyl]carbonyl}amino)propyl]-4-phenyl-4-piperidinecarboxylate [ACD/IUPAC Name]
methyl 1-[3-({[5-carbamoyl-6-(3,4-difluorophenyl)-4-ethyl-2-oxo-3,6-dihydropyrimidin-1(2H)-yl]carbonyl}amino)propyl]-4-phenylpiperidine-4-carboxylate
Methyl-1-[3-({[5-carbamoyl-6-(3,4-difluorphenyl)-4-ethyl-2-oxo-3,6-dihydro-1(2H)-pyrimidinyl]carbonyl}amino)propyl]-4-phenyl-4-piperidincarboxylat [German] [ACD/IUPAC Name]
1-(3-{[5-Carbamoyl-6-(3,4-difluoro-phenyl)-4-ethyl-2-oxo-3,6-dihydro-2H-pyrimidine-1-carbonyl]-amino}-propyl)-4-phenyl-piperidine-4-carboxylic acid methyl ester
252201-38-0 [RN]
CHEMBL356584
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL356584/
SNAP-6201

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: 1.569
Molar Refractivity: 149.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.83
ACD/LogD (pH 5.5): 0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.72
ACD/LogD (pH 7.4): 2.41
ACD/BCF (pH 7.4): 27.54
ACD/KOC (pH 7.4): 240.81
Polar Surface Area: 134 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 454.8±3.0 cm3

Click to predict properties on the Chemicalize site


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