Found 19 results

Search term: MF = 'C_{29}H_{37}N_{9}O'
ChemSpider 2D Image | 1-(4-{2-Phenyl-6-[4-(2-pyrimidinyl)-1-piperazinyl]-4-pyrimidinyl}-1-piperazinyl)-3-(1-pyrrolidinyl)-1-propanone | C29H37N9O

1-(4-{2-Phenyl-6-[4-(2-pyrimidinyl)-1-piperazinyl]-4-pyrimidinyl}-1-piperazinyl)-3-(1-pyrrolidinyl)-1-propanone

  • Molecular FormulaC29H37N9O
  • Average mass527.664 Da
  • Monoisotopic mass527.312134 Da
  • ChemSpider ID121847122

More details:

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

1-(4-{2-Phenyl-6-[4-(2-pyrimidinyl)-1-piperazinyl]-4-pyrimidinyl}-1-piperazinyl)-3-(1-pyrrolidinyl)-1-propanon [German] [ACD/IUPAC Name]
1-(4-{2-Phenyl-6-[4-(2-pyrimidinyl)-1-piperazinyl]-4-pyrimidinyl}-1-piperazinyl)-3-(1-pyrrolidinyl)-1-propanone [ACD/IUPAC Name]
1-(4-{2-Phényl-6-[4-(2-pyrimidinyl)-1-pipérazinyl]-4-pyrimidinyl}-1-pipérazinyl)-3-(1-pyrrolidinyl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[4-[2-phenyl-6-[4-(2-pyrimidinyl)-1-piperazinyl]-4-pyrimidinyl]-1-piperazinyl]-3-(1-pyrrolidinyl)- [ACD/Index 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: 721.7±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.4±3.0 kJ/mol
Flash Point: 390.3±35.7 °C
Index of Refraction: 1.624
Molar Refractivity: 149.1±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 2.03
ACD/LogD (pH 5.5): -1.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 85 Å2
Polarizability: 59.1±0.5 10-24cm3
Surface Tension: 61.0±3.0 dyne/cm
Molar Volume: 422.0±3.0 cm3

Click to predict properties on the Chemicalize site


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