ChemSpider 2D Image | 1'-{4-Amino-5-[(4-methoxyphenyl)sulfonyl]-2-pyrimidinyl}-1,4'-bipiperidine-4'-carboxamide | C22H30N6O4S

1'-{4-Amino-5-[(4-methoxyphenyl)sulfonyl]-2-pyrimidinyl}-1,4'-bipiperidine-4'-carboxamide

  • Molecular FormulaC22H30N6O4S
  • Average mass474.576 Da
  • Monoisotopic mass474.204926 Da
  • ChemSpider ID27316820

More details:

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

[1,4'-Bipiperidine]-4'-carboxamide, 1'-[4-amino-5-[(4-methoxyphenyl)sulfonyl]-2-pyrimidinyl]- [ACD/Index Name]
1'-{4-Amino-5-[(4-methoxyphenyl)sulfonyl]-2-pyrimidinyl}-1,4'-bipiperidin-4'-carboxamid [German] [ACD/IUPAC Name]
1'-{4-Amino-5-[(4-methoxyphenyl)sulfonyl]-2-pyrimidinyl}-1,4'-bipiperidine-4'-carboxamide [ACD/IUPAC Name]
1'-{4-Amino-5-[(4-méthoxyphényl)sulfonyl]-2-pyrimidinyl}-1,4'-bipipéridine-4'-carboxamide [French] [ACD/IUPAC Name]
1'-{4-amino-5-[(4-methoxyphenyl)sulfonyl]pyrimidin-2-yl}-1,4'-bipiperidine-4'-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 767.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.7±3.0 kJ/mol
Flash Point: 417.8±35.7 °C
Index of Refraction: 1.626
Molar Refractivity: 124.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 1.60
ACD/KOC (pH 5.5): 22.68
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 20.94
ACD/KOC (pH 7.4): 297.41
Polar Surface Area: 153 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 65.7±3.0 dyne/cm
Molar Volume: 350.8±3.0 cm3

Click to predict properties on the Chemicalize site


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