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ChemSpider 2D Image | N-(5-{[(3R)-1-(5-Amino-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl]amino}-1,3,4-thiadiazol-2-yl)-2-phenylacetamide | C16H18N8OS2

N-(5-{[(3R)-1-(5-Amino-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl]amino}-1,3,4-thiadiazol-2-yl)-2-phenylacetamide

  • Molecular FormulaC16H18N8OS2
  • Average mass402.497 Da
  • Monoisotopic mass402.104492 Da
  • ChemSpider ID129183684

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzeneacetamide, N-[5-[[(3R)-1-(5-amino-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl]amino]-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
N-(5-{[(3R)-1-(5-Amino-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl]amino}-1,3,4-thiadiazol-2-yl)-2-phenylacetamid [German] [ACD/IUPAC Name]
N-(5-{[(3R)-1-(5-Amino-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl]amino}-1,3,4-thiadiazol-2-yl)-2-phenylacetamide [ACD/IUPAC Name]
N-(5-{[(3R)-1-(5-Amino-1,3,4-thiadiazol-2-yl)-3-pyrrolidinyl]amino}-1,3,4-thiadiazol-2-yl)-2-phénylacétamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.781
Molar Refractivity: 107.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.66
ACD/LogD (pH 5.5): -0.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.05
ACD/LogD (pH 7.4): 1.05
ACD/BCF (pH 7.4): 3.34
ACD/KOC (pH 7.4): 73.16
Polar Surface Area: 178 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 107.2±3.0 dyne/cm
Molar Volume: 256.8±3.0 cm3

Click to predict properties on the Chemicalize site


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