Found 1 result

Search term: YJRCJVQGBKVXBL-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-[1-(3-Hydroxypropyl)-1H-indol-4-yl]-4-(1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl)-1H-pyrrole-2,5-dione | C26H24N4O3

3-[1-(3-Hydroxypropyl)-1H-indol-4-yl]-4-(1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl)-1H-pyrrole-2,5-dione

  • Molecular FormulaC26H24N4O3
  • Average mass440.494 Da
  • Monoisotopic mass440.184845 Da
  • ChemSpider ID23245319

More details:

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

1H-Pyrrole-2,5-dione, 3-[1-(3-hydroxypropyl)-1H-indol-4-yl]-4-(1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl)- [ACD/Index Name]
3-[1-(3-Hydroxypropyl)-1H-indol-4-yl]-4-(1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl)-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]
3-[1-(3-Hydroxypropyl)-1H-indol-4-yl]-4-(1,2,3,4-tetrahydro[1,4]diazepino[6,7,1-hi]indol-7-yl)-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
3-[1-(3-Hydroxypropyl)-1H-indol-4-yl]-4-(1,2,3,4-tétrahydro[1,4]diazépino[6,7,1-hi]indol-7-yl)-1H-pyrrole-2,5-dione [French] [ACD/IUPAC Name]
3-[1-(3-Hydroxy-propyl)-1H-indol-4-yl]-4-(1,2,3,4-tetrahydro-[1,4]diazepino[6,7,1-hi]indol-7-yl)-pyrrole-2,5-dione

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

Density: 1.5±0.1 g/cm3
Boiling Point: 786.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.9±3.0 kJ/mol
Flash Point: 429.1±32.9 °C
Index of Refraction: 1.753
Molar Refractivity: 123.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.40
Polar Surface Area: 88 Å2
Polarizability: 49.0±0.5 10-24cm3
Surface Tension: 63.6±7.0 dyne/cm
Molar Volume: 302.5±7.0 cm3

Click to predict properties on the Chemicalize site


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