ChemSpider 2D Image | Ethyl {1-[({2-[({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]hydrazino}carbonyl)amino]cyclohexyl}acetate | C26H35ClN6O4S

Ethyl {1-[({2-[({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]hydrazino}carbonyl)amino]cyclohexyl}acetate

  • Molecular FormulaC26H35ClN6O4S
  • Average mass563.112 Da
  • Monoisotopic mass562.212891 Da
  • ChemSpider ID102143623

More details:

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

{1-[({2-[2-({5-[2-(4-Chlorophényl)cyclopropyl]-4-éthyl-4H-1,2,4-triazol-3-yl}sulfanyl)acétyl]hydrazino}carbonyl)amino]cyclohexyl}acétate d'éthyle [French] [ACD/IUPAC Name]
Cyclohexaneacetic acid, 1-[[[2-[2-[[5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl]thio]acetyl]hydrazinyl]carbonyl]amino]-, ethyl ester [ACD/Index Name]
Ethyl {1-[({2-[({5-[2-(4-chlorophenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]hydrazino}carbonyl)amino]cyclohexyl}acetate [ACD/IUPAC Name]
Ethyl-{1-[({2-[({5-[2-(4-chlorphenyl)cyclopropyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]hydrazino}carbonyl)amino]cyclohexyl}acetat [German] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.669
Molar Refractivity: 147.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 4.04
ACD/BCF (pH 5.5): 692.58
ACD/KOC (pH 5.5): 3756.16
ACD/LogD (pH 7.4): 4.03
ACD/BCF (pH 7.4): 681.89
ACD/KOC (pH 7.4): 3698.17
Polar Surface Area: 153 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 396.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement