ChemSpider 2D Image | 2-Pyrazinyl[10-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl)-18-oxa-3,6,10,15-tetraazatricyclo[17.3.1.0~2,6~]tricosa-1(23),2,4,19,21-pentaen-15-yl]methanone | C30H31N9O3

2-Pyrazinyl[10-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl)-18-oxa-3,6,10,15-tetraazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaen-15-yl]methanone

  • Molecular FormulaC30H31N9O3
  • Average mass565.626 Da
  • Monoisotopic mass565.255005 Da
  • ChemSpider ID114940360

More details:

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

2-Pyrazinyl[10-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl)-18-oxa-3,6,10,15-tetraazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaen-15-yl]methanon [German] [ACD/IUPAC Name]
2-Pyrazinyl[10-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl)-18-oxa-3,6,10,15-tetraazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaen-15-yl]methanone [ACD/IUPAC Name]
2-Pyrazinyl[10-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl)-18-oxa-3,6,10,15-tétraazatricyclo[17.3.1.02,6]tricosa-1(23),2,4,19,21-pentaén-15-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, [6,7,8,9,10,11,12,14,15-nonahydro-8-(pyrazolo[1,5-a]pyrimidin-3-ylcarbonyl)-13H-17,21-metheno-5H,21H-imidazo[1,2-m][1,4,9,13]oxatriazacyclononadecin-13-yl]-2-pyrazinyl- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.704
Molar Refractivity: 159.7±0.5 cm3
#H bond acceptors: 12
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: -0.98
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.21
ACD/LogD (pH 7.4): 1.00
ACD/BCF (pH 7.4): 3.34
ACD/KOC (pH 7.4): 81.01
Polar Surface Area: 124 Å2
Polarizability: 63.3±0.5 10-24cm3
Surface Tension: 61.1±7.0 dyne/cm
Molar Volume: 411.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement