ChemSpider 2D Image | 2-({6-[1-(Cyanomethyl)-4-piperidinyl]-2-pyridinyl}amino)-N-[3-(4-morpholinylmethyl)benzyl]-1,3-thiazole-4-carboxamide | C28H33N7O2S

2-({6-[1-(Cyanomethyl)-4-piperidinyl]-2-pyridinyl}amino)-N-[3-(4-morpholinylmethyl)benzyl]-1,3-thiazole-4-carboxamide

  • Molecular FormulaC28H33N7O2S
  • Average mass531.672 Da
  • Monoisotopic mass531.241638 Da
  • ChemSpider ID68721041

More details:

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

2-({6-[1-(Cyanmethyl)-4-piperidinyl]-2-pyridinyl}amino)-N-[3-(4-morpholinylmethyl)benzyl]-1,3-thiazol-4-carboxamid [German] [ACD/IUPAC Name]
2-({6-[1-(Cyanomethyl)-4-piperidinyl]-2-pyridinyl}amino)-N-[3-(4-morpholinylmethyl)benzyl]-1,3-thiazole-4-carboxamide [ACD/IUPAC Name]
2-({6-[1-(Cyanométhyl)-4-pipéridinyl]-2-pyridinyl}amino)-N-[3-(4-morpholinylméthyl)benzyl]-1,3-thiazole-4-carboxamide [French] [ACD/IUPAC Name]
4-Thiazolecarboxamide, 2-[[6-[1-(cyanomethyl)-4-piperidinyl]-2-pyridinyl]amino]-N-[[3-(4-morpholinylmethyl)phenyl]methyl]- [ACD/Index Name]

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: 1.640
Molar Refractivity: 148.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.33
ACD/LogD (pH 5.5): 0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 11.44
ACD/LogD (pH 7.4): 1.42
ACD/BCF (pH 7.4): 6.91
ACD/KOC (pH 7.4): 133.76
Polar Surface Area: 135 Å2
Polarizability: 59.0±0.5 10-24cm3
Surface Tension: 63.5±3.0 dyne/cm
Molar Volume: 413.1±3.0 cm3

Click to predict properties on the Chemicalize site


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