Found 1 result

Search term: MLQADPZIWYJXFF (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 6-Benzyl-4-(5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-2-(1-pyrrolidinyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine | C23H28N8

6-Benzyl-4-(5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-2-(1-pyrrolidinyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine

  • Molecular FormulaC23H28N8
  • Average mass416.522 Da
  • Monoisotopic mass416.243683 Da
  • ChemSpider ID22513248

More details:

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

6-Benzyl-4-(5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-2-(1-pyrrolidinyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin [German] [ACD/IUPAC Name]
6-Benzyl-4-(5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-2-(1-pyrrolidinyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine [ACD/IUPAC Name]
6-Benzyl-4-(5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl)-2-(1-pyrrolidinyl)-5,6,7,8-tétrahydropyrido[4,3-d]pyrimidine [French] [ACD/IUPAC Name]
Pyrido[4,3-d]pyrimidine, 4-(5,6-dihydro-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl)-5,6,7,8-tetrahydro-6-(phenylmethyl)-2-(1-pyrrolidinyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 692.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.8±34.3 °C
Index of Refraction: 1.764
Molar Refractivity: 121.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.73
ACD/LogD (pH 5.5): -0.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.63
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 5.78
ACD/KOC (pH 7.4): 93.54
Polar Surface Area: 66 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 63.7±7.0 dyne/cm
Molar Volume: 293.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement