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Search term: AEFKPNYWNAAZGP-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 2-Methyl-4'-{8-[(3-methyl-2-pyridinyl)methyl]-1-(6-methyl-4-pyrimidinyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-3-yl}-4-biphenylcarboxylic acid | C33H32N6O4

2-Methyl-4'-{8-[(3-methyl-2-pyridinyl)methyl]-1-(6-methyl-4-pyrimidinyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-3-yl}-4-biphenylcarboxylic acid

  • Molecular FormulaC33H32N6O4
  • Average mass576.645 Da
  • Monoisotopic mass576.248474 Da
  • ChemSpider ID28517655

More details:

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

[1,1'-Biphenyl]-4-carboxylic acid, 2-methyl-4'-[8-[(3-methyl-2-pyridinyl)methyl]-1-(6-methyl-4-pyrimidinyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-3-yl]- [ACD/Index Name]
2-Methyl-4'-{8-[(3-methyl-2-pyridinyl)methyl]-1-(6-methyl-4-pyrimidinyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-3-yl}-4-biphenylcarbonsäure [German] [ACD/IUPAC Name]
2-Methyl-4'-{8-[(3-methyl-2-pyridinyl)methyl]-1-(6-methyl-4-pyrimidinyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]dec-3-yl}-4-biphenylcarboxylic acid [ACD/IUPAC Name]
Acide 2-méthyl-4'-{8-[(3-méthyl-2-pyridinyl)méthyl]-1-(6-méthyl-4-pyrimidinyl)-2,4-dioxo-1,3,8-triazaspiro[4.5]déc-3-yl}-4-biphénylcarboxylique [French] [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: 761.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 116.4±3.0 kJ/mol
Flash Point: 414.3±35.7 °C
Index of Refraction: 1.708
Molar Refractivity: 159.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 1.93
ACD/BCF (pH 5.5): 4.97
ACD/KOC (pH 5.5): 25.22
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 1.61
ACD/KOC (pH 7.4): 8.19
Polar Surface Area: 120 Å2
Polarizability: 63.1±0.5 10-24cm3
Surface Tension: 82.7±5.0 dyne/cm
Molar Volume: 408.7±5.0 cm3

Click to predict properties on the Chemicalize site


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