ChemSpider 2D Image | LBP-1 | C23H29ClN6O3

LBP-1

  • Molecular FormulaC23H29ClN6O3
  • Average mass472.968 Da
  • Monoisotopic mass472.198975 Da
  • ChemSpider ID28530409

More details:

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

1050478-18-6 [RN]
1-Piperazineacetamide, 4-[[3-[7-chloro-1-[(tetrahydro-2H-pyran-4-yl)methyl]-1H-indol-3-yl]-1,2,4-oxadiazol-5-yl]methyl]- [ACD/Index Name]
2-[4-({3-[7-Chlor-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-indol-3-yl]-1,2,4-oxadiazol-5-yl}methyl)-1-piperazinyl]acetamid [German] [ACD/IUPAC Name]
2-[4-({3-[7-Chloro-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-indol-3-yl]-1,2,4-oxadiazol-5-yl}methyl)-1-piperazinyl]acetamide [ACD/IUPAC Name]
2-[4-({3-[7-Chloro-1-(tétrahydro-2H-pyran-4-ylméthyl)-1H-indol-3-yl]-1,2,4-oxadiazol-5-yl}méthyl)-1-pipérazinyl]acétamide [French] [ACD/IUPAC Name]
4-[[3-[7-Chloro-1-[(tetrahydro-2H-pyran-4-yl)methyl]-1H-indol-3-yl]-1,2,4-oxadiazol-5-yl]methyl]-1-piperazineacetamide
LBP-1
1-Piperazineacetamide, 4-((3-(7-chloro-1-((tetrahydro-2H-pyran-4-yl)methyl)-1H-indol-3-yl)-1,2,4-oxadiazol-5-yl)methyl)-
2-[4-[[3-[7-chloro-1-(oxan-4-ylmethyl)indol-3-yl]-1,2,4-oxadiazol-5-yl]methyl]piperazin-1-yl]acetamide
2-{4-[(3-{7-Chloro-1-[(oxan-4-yl)methyl]-1H-indol-3-yl}-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl}acetamide
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 717.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.8±3.0 kJ/mol
Flash Point: 387.4±35.7 °C
Index of Refraction: 1.707
Molar Refractivity: 123.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 1.90
ACD/BCF (pH 5.5): 15.74
ACD/KOC (pH 5.5): 238.00
ACD/LogD (pH 7.4): 1.98
ACD/BCF (pH 7.4): 18.73
ACD/KOC (pH 7.4): 283.30
Polar Surface Area: 103 Å2
Polarizability: 49.1±0.5 10-24cm3
Surface Tension: 61.4±7.0 dyne/cm
Molar Volume: 318.1±7.0 cm3

Click to predict properties on the Chemicalize site


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