ChemSpider 2D Image | 2-{4-[(Methylsulfanyl)methyl]-1-piperidinyl}-N-(1,3,4-thiadiazol-2-yl)propanamide | C12H20N4OS2

2-{4-[(Methylsulfanyl)methyl]-1-piperidinyl}-N-(1,3,4-thiadiazol-2-yl)propanamide

  • Molecular FormulaC12H20N4OS2
  • Average mass300.443 Da
  • Monoisotopic mass300.107849 Da
  • ChemSpider ID52573328

More details:

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

1-Piperidineacetamide, α-methyl-4-[(methylthio)methyl]-N-1,3,4-thiadiazol-2-yl- [ACD/Index Name]
2-{4-[(Methylsulfanyl)methyl]-1-piperidinyl}-N-(1,3,4-thiadiazol-2-yl)propanamid [German] [ACD/IUPAC Name]
2-{4-[(Methylsulfanyl)methyl]-1-piperidinyl}-N-(1,3,4-thiadiazol-2-yl)propanamide [ACD/IUPAC Name]
2-{4-[(Méthylsulfanyl)méthyl]-1-pipéridinyl}-N-(1,3,4-thiadiazol-2-yl)propanamide [French] [ACD/IUPAC Name]
2-{4-[(methylthio)methyl]piperidin-1-yl}-N-1,3,4-thiadiazol-2-ylpropanamide

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: 1.601
Molar Refractivity: 81.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.07
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 4.26
ACD/KOC (pH 7.4): 79.21
Polar Surface Area: 112 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 238.1±3.0 cm3

Click to predict properties on the Chemicalize site


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