Found 597 results

Search term: MF = 'C_{26}H_{26}N_{6}O_{3}S'
ChemSpider 2D Image | N-{4-[({[4-Ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-5-methoxy-2-methylphenyl}benzamide | C26H26N6O3S

N-{4-[({[4-Ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-5-methoxy-2-methylphenyl}benzamide

  • Molecular FormulaC26H26N6O3S
  • Average mass502.588 Da
  • Monoisotopic mass502.178711 Da
  • ChemSpider ID1852318

More details:

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

Benzamide, N-[4-[[2-[[4-ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]acetyl]amino]-5-methoxy-2-methylphenyl]- [ACD/Index Name]
N-{4-[({[4-Ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-5-methoxy-2-methylphenyl}benzamid [German] [ACD/IUPAC Name]
N-{4-[({[4-Ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-5-methoxy-2-methylphenyl}benzamide [ACD/IUPAC Name]
N-{4-[(2-{[4-Éthyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acétyl)amino]-5-méthoxy-2-méthylphényl}benzamide [French] [ACD/IUPAC Name]
2-(4-ethyl-5-(4-pyridyl)(1,2,4-triazol-3-ylthio))-N-[2-methoxy-5-methyl-4-(phenylcarbonylamino)phenyl]acetamide

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

ZINC03364330 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.660
Molar Refractivity: 141.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 284.07
ACD/KOC (pH 5.5): 1982.98
ACD/LogD (pH 7.4): 3.53
ACD/BCF (pH 7.4): 285.10
ACD/KOC (pH 7.4): 1990.15
Polar Surface Area: 136 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 383.8±7.0 cm3

Click to predict properties on the Chemicalize site


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