ChemSpider 2D Image | 1-(Methylsulfonyl)-N-(6-{[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]amino}-3-pyridinyl)-4-piperidinecarboxamide | C19H21N5O7S2

1-(Methylsulfonyl)-N-(6-{[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]amino}-3-pyridinyl)-4-piperidinecarboxamide

  • Molecular FormulaC19H21N5O7S2
  • Average mass495.529 Da
  • Monoisotopic mass495.088226 Da
  • ChemSpider ID66681108

More details:

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

1-(Methylsulfonyl)-N-(6-{[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]amino}-3-pyridinyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-(Methylsulfonyl)-N-(6-{[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]amino}-3-pyridinyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
1-(Méthylsulfonyl)-N-(6-{[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]amino}-3-pyridinyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, N-[6-[[(2,3-dihydro-2-oxo-6-benzoxazolyl)sulfonyl]amino]-3-pyridinyl]-1-(methylsulfonyl)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.697
Molar Refractivity: 116.6±0.4 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.33
ACD/LogD (pH 5.5): 0.41
ACD/BCF (pH 5.5): 1.20
ACD/KOC (pH 5.5): 39.66
ACD/LogD (pH 7.4): 0.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 24.96
Polar Surface Area: 181 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 88.6±5.0 dyne/cm
Molar Volume: 302.6±5.0 cm3

Click to predict properties on the Chemicalize site


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