Found 19 results

Search term: MF = 'C_{29}H_{37}N_{9}O'
ChemSpider 2D Image | N~6~-{1-[4-(Dimethylamino)benzyl]-4-piperidinyl}-N~2~-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine | C29H37N9O

N6-{1-[4-(Dimethylamino)benzyl]-4-piperidinyl}-N2-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine

  • Molecular FormulaC29H37N9O
  • Average mass527.664 Da
  • Monoisotopic mass527.312134 Da
  • ChemSpider ID9618775

More details:

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

7H-Purine-2,6-diamine, N6-[1-[[4-(dimethylamino)phenyl]methyl]-4-piperidinyl]-N2-[4-(4-morpholinyl)phenyl]- [ACD/Index Name]
N6-{1-[4-(Dimethylamino)benzyl]-4-piperidinyl}-N2-[4-(4-morpholinyl)phenyl]-7H-purin-2,6-diamin [German] [ACD/IUPAC Name]
N6-{1-[4-(Dimethylamino)benzyl]-4-piperidinyl}-N2-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine [ACD/IUPAC Name]
N6-{1-[4-(Diméthylamino)benzyl]-4-pipéridinyl}-N2-[4-(4-morpholinyl)phényl]-7H-purine-2,6-diamine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 819.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.1±3.0 kJ/mol
Flash Point: 449.4±37.1 °C
Index of Refraction: 1.714
Molar Refractivity: 157.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.09
ACD/LogD (pH 5.5): -0.60
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 3.48
ACD/KOC (pH 7.4): 35.19
Polar Surface Area: 97 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 74.2±3.0 dyne/cm
Molar Volume: 400.2±3.0 cm3

Click to predict properties on the Chemicalize site


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