Found 597 results

Search term: MF = 'C_{26}H_{26}N_{6}O_{3}S'
ChemSpider 2D Image | Ethyl 4-(2,5-dimethylphenyl)-6-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate | C26H26N6O3S

Ethyl 4-(2,5-dimethylphenyl)-6-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

  • Molecular FormulaC26H26N6O3S
  • Average mass502.588 Da
  • Monoisotopic mass502.178711 Da
  • ChemSpider ID4455120

More details:

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

4-(2,5-Diméthylphényl)-6-{[(5-méthyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]méthyl}-2-oxo-1,2,3,4-tétrahydro-5-pyrimidinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxylic acid, 4-(2,5-dimethylphenyl)-1,2,3,4-tetrahydro-6-[[(5-methyl-5H-1,2,4-triazino[5,6-b]indol-3-yl)thio]methyl]-2-oxo-, ethyl ester [ACD/Index Name]
Ethyl 4-(2,5-dimethylphenyl)-6-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate [ACD/IUPAC Name]
Ethyl-4-(2,5-dimethylphenyl)-6-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydro-5-pyrimidincarboxylat [German] [ACD/IUPAC Name]
4-(2,5-Dimethyl-phenyl)-6-(9-methyl-9H-1,3,4,9-tetraaza-fluoren-2-ylsulfanylmethyl)-2-oxo-1,2,3,4-tetrahydro-pyrimidine-5-carboxylic acid ethyl ester
ethyl 4-(2,5-dimethylphenyl)-6-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 4-(2,5-dimethylphenyl)-6-{[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]methyl}-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
ethyl 6-(2,5-dimethylphenyl)-4-[(5-methyl(1,2,4-triazino[5,6-b]indol-3-ylthio))methyl]-2-oxo-1,3,6-trihydropyrimidine-5-carboxylate

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

A3490/0147939 [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: 1.713
Molar Refractivity: 139.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.38
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1357.63
ACD/KOC (pH 5.5): 6073.29
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1363.24
ACD/KOC (pH 7.4): 6098.43
Polar Surface Area: 136 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 55.4±7.0 dyne/cm
Molar Volume: 354.4±7.0 cm3

Click to predict properties on the Chemicalize site


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