ChemSpider 2D Image | N-[1-(1,3-Benzothiazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-5-nitro-2-thiophenecarboxamide | C16H11N5O3S2

N-[1-(1,3-Benzothiazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-5-nitro-2-thiophenecarboxamide

  • Molecular FormulaC16H11N5O3S2
  • Average mass385.420 Da
  • Monoisotopic mass385.030334 Da
  • ChemSpider ID22342296

More details:

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

2-Thiophenecarboxamide, N-[1-(2-benzothiazolyl)-3-methyl-1H-pyrazol-5-yl]-5-nitro- [ACD/Index Name]
N-[1-(1,3-Benzothiazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-5-nitro-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-[1-(1,3-Benzothiazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-5-nitro-2-thiophenecarboxamide [ACD/IUPAC Name]
N-[1-(1,3-Benzothiazol-2-yl)-3-méthyl-1H-pyrazol-5-yl]-5-nitro-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
1172318-39-6 [RN]
N-(1-(benzo[d]thiazol-2-yl)-3-methyl-1H-pyrazol-5-yl)-5-nitrothiophene-2-carboxamide
N-[1-(1,3-benzothiazol-2-yl)-3-methyl-1H-pyrazol-5-yl]-5-nitrothiophene-2-carboxamide
N-[2-(1,3-benzothiazol-2-yl)-5-methylpyrazol-3-yl]-5-nitrothiophene-2-carboxamide

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.823
Molar Refractivity: 101.2±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.15
ACD/BCF (pH 5.5): 146.70
ACD/KOC (pH 5.5): 1236.92
ACD/LogD (pH 7.4): 3.15
ACD/BCF (pH 7.4): 146.67
ACD/KOC (pH 7.4): 1236.67
Polar Surface Area: 162 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 78.1±7.0 dyne/cm
Molar Volume: 231.8±7.0 cm3

Click to predict properties on the Chemicalize site


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