ChemSpider 2D Image | N-(5-{[(5-Nitro-2-thienyl)methylene]amino}-1,3,4-thiadiazol-2-yl)-4-(1-piperidinylsulfonyl)benzamide | C19H18N6O5S3

N-(5-{[(5-Nitro-2-thienyl)methylene]amino}-1,3,4-thiadiazol-2-yl)-4-(1-piperidinylsulfonyl)benzamide

  • Molecular FormulaC19H18N6O5S3
  • Average mass506.578 Da
  • Monoisotopic mass506.050079 Da
  • ChemSpider ID3198907

More details:

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

Benzamide, N-[5-[[(5-nitro-2-thienyl)methylene]amino]-1,3,4-thiadiazol-2-yl]-4-(1-piperidinylsulfonyl)- [ACD/Index Name]
N-(5-{[(5-Nitro-2-thienyl)methylen]amino}-1,3,4-thiadiazol-2-yl)-4-(1-piperidinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
N-(5-{[(5-Nitro-2-thienyl)methylene]amino}-1,3,4-thiadiazol-2-yl)-4-(1-piperidinylsulfonyl)benzamide [ACD/IUPAC Name]
N-(5-{[(5-Nitro-2-thiényl)méthylène]amino}-1,3,4-thiadiazol-2-yl)-4-(1-pipéridinylsulfonyl)benzamide [French] [ACD/IUPAC Name]

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

ZINC01883242 [DBID]

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: 1.778
Molar Refractivity: 128.0±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 179.99
ACD/KOC (pH 5.5): 1430.17
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 148.39
ACD/KOC (pH 7.4): 1179.06
Polar Surface Area: 215 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 79.7±7.0 dyne/cm
Molar Volume: 305.7±7.0 cm3

Click to predict properties on the Chemicalize site


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