ChemSpider 2D Image | Methyl 2-[({[2-({[4-(diethylamino)butyl]carbamoyl}amino)-3-pyridinyl]oxy}acetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate | C22H32N6O5S

Methyl 2-[({[2-({[4-(diethylamino)butyl]carbamoyl}amino)-3-pyridinyl]oxy}acetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate

  • Molecular FormulaC22H32N6O5S
  • Average mass492.592 Da
  • Monoisotopic mass492.215485 Da
  • ChemSpider ID65974437

More details:

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

2-[(2-{[2-({[4-(Diéthylamino)butyl]carbamoyl}amino)-3-pyridinyl]oxy}acétyl)amino]-4-méthyl-1,3-thiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-[[2-[[2-[[[[4-(diethylamino)butyl]amino]carbonyl]amino]-3-pyridinyl]oxy]acetyl]amino]-4-methyl-, methyl ester [ACD/Index Name]
Methyl 2-[({[2-({[4-(diethylamino)butyl]carbamoyl}amino)-3-pyridinyl]oxy}acetyl)amino]-4-methyl-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Methyl-2-[({[2-({[4-(diethylamino)butyl]carbamoyl}amino)-3-pyridinyl]oxy}acetyl)amino]-4-methyl-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC 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: 1.600
Molar Refractivity: 132.0±0.3 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 2.51
ACD/LogD (pH 5.5): -0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.99
Polar Surface Area: 163 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 385.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement