ChemSpider 2D Image | N-[4-(4-{[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-1-piperazinyl)phenyl]methanesulfonamide | C15H21N7O3S2

N-[4-(4-{[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-1-piperazinyl)phenyl]methanesulfonamide

  • Molecular FormulaC15H21N7O3S2
  • Average mass411.502 Da
  • Monoisotopic mass411.114716 Da
  • ChemSpider ID126880311

More details:

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

Methanesulfonamide, N-[4-[4-[2-[(1-methyl-1H-tetrazol-5-yl)thio]acetyl]-1-piperazinyl]phenyl]- [ACD/Index Name]
N-[4-(4-{[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-1-piperazinyl)phenyl]methanesulfonamide [ACD/IUPAC Name]
N-[4-(4-{[(1-Methyl-1H-tetrazol-5-yl)sulfanyl]acetyl}-1-piperazinyl)phenyl]methansulfonamid [German] [ACD/IUPAC Name]
N-[4-(4-{2-[(1-Méthyl-1H-tétrazol-5-yl)sulfanyl]acétyl}-1-pipérazinyl)phényl]méthanesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 683.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.2±34.3 °C
Index of Refraction: 1.716
Molar Refractivity: 106.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -0.17
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.36
ACD/LogD (pH 7.4): -0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.29
Polar Surface Area: 147 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 66.7±7.0 dyne/cm
Molar Volume: 270.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement