Found 19 results

Search term: MF = 'C_{29}H_{37}N_{9}O'
ChemSpider 2D Image | N~4~-(1H-Indazol-6-yl)-N~2~-{2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl}-5-methyl-2,4-pyrimidinediamine | C29H37N9O

N4-(1H-Indazol-6-yl)-N2-{2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl}-5-methyl-2,4-pyrimidinediamine

  • Molecular FormulaC29H37N9O
  • Average mass527.664 Da
  • Monoisotopic mass527.312134 Da
  • ChemSpider ID129207965

More details:

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

2,4-Pyrimidinediamine, N4-1H-indazol-6-yl-N2-[2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl]-5-methyl- [ACD/Index Name]
N4-(1H-Indazol-6-yl)-N2-{2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl}-5-methyl-2,4-pyrimidindiamin [German] [ACD/IUPAC Name]
N4-(1H-Indazol-6-yl)-N2-{2-methoxy-4-[4-(4-methyl-1-piperazinyl)-1-piperidinyl]phenyl}-5-methyl-2,4-pyrimidinediamine [ACD/IUPAC Name]
N4-(1H-Indazol-6-yl)-N2-{2-méthoxy-4-[4-(4-méthyl-1-pipérazinyl)-1-pipéridinyl]phényl}-5-méthyl-2,4-pyrimidinediamine [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: 784.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.1±3.0 kJ/mol
Flash Point: 428.0±35.7 °C
Index of Refraction: 1.691
Molar Refractivity: 156.2±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.82
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.07
ACD/LogD (pH 7.4): 2.80
ACD/BCF (pH 7.4): 45.81
ACD/KOC (pH 7.4): 282.91
Polar Surface Area: 97 Å2
Polarizability: 61.9±0.5 10-24cm3
Surface Tension: 68.0±3.0 dyne/cm
Molar Volume: 408.4±3.0 cm3

Click to predict properties on the Chemicalize site


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