Found 111 results

Search term: MF = 'C_{24}H_{37}N_{5}OS'
ChemSpider 2D Image | 1-Isobutyl-4-[4-(3-methoxyphenyl)-5-{[2-(1-pyrrolidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]piperidine | C24H37N5OS

1-Isobutyl-4-[4-(3-methoxyphenyl)-5-{[2-(1-pyrrolidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]piperidine

  • Molecular FormulaC24H37N5OS
  • Average mass443.648 Da
  • Monoisotopic mass443.271881 Da
  • ChemSpider ID22212978

More details:

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

1-Isobutyl-4-[4-(3-methoxyphenyl)-5-{[2-(1-pyrrolidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]piperidin [German] [ACD/IUPAC Name]
1-Isobutyl-4-[4-(3-methoxyphenyl)-5-{[2-(1-pyrrolidinyl)ethyl]sulfanyl}-4H-1,2,4-triazol-3-yl]piperidine [ACD/IUPAC Name]
1-Isobutyl-4-[4-(3-méthoxyphényl)-5-{[2-(1-pyrrolidinyl)éthyl]sulfanyl}-4H-1,2,4-triazol-3-yl]pipéridine [French] [ACD/IUPAC Name]
Piperidine, 4-[4-(3-methoxyphenyl)-5-[[2-(1-pyrrolidinyl)ethyl]thio]-4H-1,2,4-triazol-3-yl]-1-(2-methylpropyl)- [ACD/Index Name]
1-isobutyl-4-(4-(3-methoxyphenyl)-5-{[2-(1-pyrrolidinyl)ethyl]thio}-4H-1,2,4-triazol-3-yl)piperidine

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

Density: 1.2±0.1 g/cm3
Boiling Point: 605.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.1±3.0 kJ/mol
Flash Point: 320.3±34.3 °C
Index of Refraction: 1.629
Molar Refractivity: 129.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 1.23
ACD/KOC (pH 7.4): 5.63
Polar Surface Area: 72 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 46.0±7.0 dyne/cm
Molar Volume: 364.8±7.0 cm3

Click to predict properties on the Chemicalize site


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