Found 164 results

Search term: MF = 'C_{35}H_{40}N_{4}O'
ChemSpider 2D Image | 1-(2-Methoxyphenyl)-2-{2-[4-(2-methyl-2-propanyl)phenyl]-6-(1-piperidinyl)-4-pyrimidinyl}-1,2,3,4-tetrahydroisoquinoline | C35H40N4O

1-(2-Methoxyphenyl)-2-{2-[4-(2-methyl-2-propanyl)phenyl]-6-(1-piperidinyl)-4-pyrimidinyl}-1,2,3,4-tetrahydroisoquinoline

  • Molecular FormulaC35H40N4O
  • Average mass532.718 Da
  • Monoisotopic mass532.320190 Da
  • ChemSpider ID122017230

More details:

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

1-(2-Methoxyphenyl)-2-{2-[4-(2-methyl-2-propanyl)phenyl]-6-(1-piperidinyl)-4-pyrimidinyl}-1,2,3,4-tetrahydroisochinolin [German] [ACD/IUPAC Name]
1-(2-Méthoxyphényl)-2-{2-[4-(2-méthyl-2-propanyl)phényl]-6-(1-pipéridinyl)-4-pyrimidinyl}-1,2,3,4-tétrahydroisoquinoléine [French] [ACD/IUPAC Name]
1-(2-Methoxyphenyl)-2-{2-[4-(2-methyl-2-propanyl)phenyl]-6-(1-piperidinyl)-4-pyrimidinyl}-1,2,3,4-tetrahydroisoquinoline [ACD/IUPAC Name]
Isoquinoline, 2-[2-[4-(1,1-dimethylethyl)phenyl]-6-(1-piperidinyl)-4-pyrimidinyl]-1,2,3,4-tetrahydro-1-(2-methoxyphenyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 634.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 337.6±31.5 °C
Index of Refraction: 1.603
Molar Refractivity: 161.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 7.65
ACD/LogD (pH 5.5): 5.13
ACD/BCF (pH 5.5): 1179.81
ACD/KOC (pH 5.5): 1078.96
ACD/LogD (pH 7.4): 5.60
ACD/BCF (pH 7.4): 3482.18
ACD/KOC (pH 7.4): 3184.53
Polar Surface Area: 41 Å2
Polarizability: 64.0±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 470.4±3.0 cm3

Click to predict properties on the Chemicalize site


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