ChemSpider 2D Image | 6-Amino-5-(2,2-diethoxyethyl)-2-((4-(4-methylpiperazin-1-yl)phenyl)amino)pyrimidin-4(3H)-one | C21H32N6O3

6-Amino-5-(2,2-diethoxyethyl)-2-((4-(4-methylpiperazin-1-yl)phenyl)amino)pyrimidin-4(3H)-one

  • Molecular FormulaC21H32N6O3
  • Average mass416.517 Da
  • Monoisotopic mass416.253601 Da
  • ChemSpider ID28600217

More details:

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

1245649-22-2 [RN]
4(3H)-Pyrimidinone, 6-amino-5-(2,2-diethoxyethyl)-2-[[4-(4-methyl-1-piperazinyl)phenyl]amino]- [ACD/Index Name]
6-Amino-5-(2,2-diethoxyethyl)-2-((4-(4-methylpiperazin-1-yl)phenyl)amino)pyrimidin-4(3H)-one
6-Amino-5-(2,2-diethoxyethyl)-2-{[4-(4-methyl-1-piperazinyl)phenyl]amino}-4(1H)-pyrimidinon [German] [ACD/IUPAC Name]
6-Amino-5-(2,2-diethoxyethyl)-2-{[4-(4-methyl-1-piperazinyl)phenyl]amino}-4(1H)-pyrimidinone [ACD/IUPAC Name]
6-Amino-5-(2,2-diéthoxyéthyl)-2-{[4-(4-méthyl-1-pipérazinyl)phényl]amino}-4(1H)-pyrimidinone [French] [ACD/IUPAC Name]
6-AMINO-5-(2,2-DIETHOXYETHYL)-2-(4-(4-METHYLPIPERAZIN-1-YL)PHENYLAMINO)PYRIMIDIN-4-OL
6-Amino-5-(2,2-diethoxyethyl)-2-[4-(4-methylpiperazin-1-yl)anilino]pyrimidin-4(1H)-one
MFCD16877465 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.617
Molar Refractivity: 113.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): -1.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.60
ACD/BCF (pH 7.4): 1.11
ACD/KOC (pH 7.4): 23.04
Polar Surface Area: 104 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 325.1±7.0 cm3

Click to predict properties on the Chemicalize site


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