ChemSpider 2D Image | 1-[(5-Methyl-1,3,4-thiadiazol-2-yl)methyl]-4-(1-pyrrolidinylsulfonyl)piperazine | C12H21N5O2S2

1-[(5-Methyl-1,3,4-thiadiazol-2-yl)methyl]-4-(1-pyrrolidinylsulfonyl)piperazine

  • Molecular FormulaC12H21N5O2S2
  • Average mass331.457 Da
  • Monoisotopic mass331.113678 Da
  • ChemSpider ID52565269

More details:

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

1-[(5-Methyl-1,3,4-thiadiazol-2-yl)methyl]-4-(1-pyrrolidinylsulfonyl)piperazin [German] [ACD/IUPAC Name]
1-[(5-Methyl-1,3,4-thiadiazol-2-yl)methyl]-4-(1-pyrrolidinylsulfonyl)piperazine [ACD/IUPAC Name]
1-[(5-Méthyl-1,3,4-thiadiazol-2-yl)méthyl]-4-(1-pyrrolidinylsulfonyl)pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-4-(1-pyrrolidinylsulfonyl)- [ACD/Index Name]
1-[(5-methyl-1,3,4-thiadiazol-2-yl)methyl]-4-(pyrrolidin-1-ylsulfonyl)piperazine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 515.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.5±30.1 °C
Index of Refraction: 1.640
Molar Refractivity: 83.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.05
ACD/LogD (pH 5.5): -0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.42
ACD/LogD (pH 7.4): -0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 17.16
Polar Surface Area: 106 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 74.4±5.0 dyne/cm
Molar Volume: 230.9±5.0 cm3

Click to predict properties on the Chemicalize site


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