ChemSpider 2D Image | N-[2-(2,5-Dimethoxyphenyl)ethyl]-5-(8-methoxy-4-oxo-2-thioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanamide | C26H30N4O5S

N-[2-(2,5-Dimethoxyphenyl)ethyl]-5-(8-methoxy-4-oxo-2-thioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanamide

  • Molecular FormulaC26H30N4O5S
  • Average mass510.605 Da
  • Monoisotopic mass510.193695 Da
  • ChemSpider ID1609340

More details:

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

3H-Pyrimido[5,4-b]indole-3-pentanamide, N-[2-(2,5-dimethoxyphenyl)ethyl]-1,2,4,5-tetrahydro-8-methoxy-4-oxo-2-thioxo- [ACD/Index Name]
N-[2-(2,5-Dimethoxyphenyl)ethyl]-5-(8-methoxy-4-oxo-2-thioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanamid [German] [ACD/IUPAC Name]
N-[2-(2,5-Dimethoxyphenyl)ethyl]-5-(8-methoxy-4-oxo-2-thioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanamide [ACD/IUPAC Name]
N-[2-(2,5-Diméthoxyphényl)éthyl]-5-(8-méthoxy-4-oxo-2-thioxo-1,2,4,5-tétrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanamide [French] [ACD/IUPAC Name]
5-(6-Methoxy-1-oxo-3-thioxo-1,3,4,9-tetrahydro-2,4,9-triaza-fluoren-2-yl)-pentanoic acid [2-(2,5-dimethoxy-phenyl)-ethyl]-amide

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: 1.668
Molar Refractivity: 140.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 2.39
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 241.20
ACD/KOC (pH 5.5): 1765.68
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 241.16
ACD/KOC (pH 7.4): 1765.36
Polar Surface Area: 137 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 70.2±5.0 dyne/cm
Molar Volume: 376.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement