Found 597 results

Search term: MF = 'C_{26}H_{26}N_{6}O_{3}S'

ChemSpider 2D Image | MFCD04021859 | C26H26N6O3S

MFCD04021859

  • Molecular FormulaC26H26N6O3S
  • Average mass502.588 Da
  • Monoisotopic mass502.178711 Da
  • ChemSpider ID1491648

More details:






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

2-{[4-Amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(9-ethyl-9H-carbazol-3-yl)acetamid [German] [ACD/IUPAC Name]
2-{[4-Amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(9-ethyl-9H-carbazol-3-yl)acetamide [ACD/IUPAC Name]
2-{[4-Amino-5-(3,4-diméthoxyphényl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(9-éthyl-9H-carbazol-3-yl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[4-amino-5-(3,4-dimethoxyphenyl)-4H-1,2,4-triazol-3-yl]thio]-N-(9-ethyl-9H-carbazol-3-yl)- [ACD/Index Name]
MFCD04021859
2-[[4-amino-5-(3,4-dimethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(9-ethylcarbazol-3-yl)acetamide
2-[4-amino-5-(3,4-dimethoxyphenyl)(1,2,4-triazol-3-ylthio)]-N-(9-ethylcarbazol-3-yl)acetamide
2-[4-Amino-5-(3,4-dimethoxy-phenyl)-4H-[1,2,4]triazol-3-ylsulfanyl]-N-(9-ethyl-9H-carbazol-3-yl)-acetami de
577986-50-6 [RN]

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

MLS000558025 [DBID]
SMR000148741 [DBID]
ZINC02337151 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.696
    Molar Refractivity: 139.5±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 2
    ACD/LogP: 5.90
    ACD/LogD (pH 5.5): 4.04
    ACD/BCF (pH 5.5): 688.44
    ACD/KOC (pH 5.5): 3740.56
    ACD/LogD (pH 7.4): 4.04
    ACD/BCF (pH 7.4): 688.50
    ACD/KOC (pH 7.4): 3740.87
    Polar Surface Area: 135 Å2
    Polarizability: 55.3±0.5 10-24cm3
    Surface Tension: 55.5±7.0 dyne/cm
    Molar Volume: 362.7±7.0 cm3

    Click to predict properties on the Chemicalize site






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