ChemSpider 2D Image | N-Isopropyl-3-({4-methyl-5-[(methylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide | C11H21N5OS

N-Isopropyl-3-({4-methyl-5-[(methylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide

  • Molecular FormulaC11H21N5OS
  • Average mass271.382 Da
  • Monoisotopic mass271.146667 Da
  • ChemSpider ID57627468

More details:

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

N-Isopropyl-3-({4-methyl-5-[(methylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamid [German] [ACD/IUPAC Name]
N-Isopropyl-3-({4-methyl-5-[(methylamino)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide [ACD/IUPAC Name]
N-Isopropyl-3-({4-méthyl-5-[(méthylamino)méthyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamide [French] [ACD/IUPAC Name]
Propanamide, N-(1-methylethyl)-3-[[4-methyl-5-[(methylamino)methyl]-4H-1,2,4-triazol-3-yl]thio]- [ACD/Index Name]
N-isopropyl-3-({4-methyl-5-[(methylamino)methyl]-4H-1,2,4-triazol-3-yl}thio)propanamide

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.598
Molar Refractivity: 74.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.09
ACD/LogD (pH 5.5): -1.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.32
Polar Surface Area: 97 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 43.4±7.0 dyne/cm
Molar Volume: 219.2±7.0 cm3

Click to predict properties on the Chemicalize site


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