ChemSpider 2D Image | 2-({[5-{2,6-Bis[(~3~H_3_)methyloxy]phenyl}-1-(7-chloro-4-quinolinyl)-1H-pyrazol-3-yl]carbonyl}amino)-2-adamantanecarboxylic acid | C32H25T6ClN4O5

2-({[5-{2,6-Bis[(3H3)methyloxy]phenyl}-1-(7-chloro-4-quinolinyl)-1H-pyrazol-3-yl]carbonyl}amino)-2-adamantanecarboxylic acid

  • Molecular FormulaC32H25T6ClN4O5
  • Average mass599.114 Da
  • Monoisotopic mass598.247620 Da
  • ChemSpider ID26377924

  • Non-standard isotope - Non-standard isotope

More details:

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

2-({[5-{2,6-Bis[(3H3)methyloxy]phenyl}-1-(7-chlor-4-chinolinyl)-1H-pyrazol-3-yl]carbonyl}amino)-2-adamantancarbonsäure [German] [ACD/IUPAC Name]
2-({[5-{2,6-Bis[(3H3)methyloxy]phenyl}-1-(7-chloro-4-quinolinyl)-1H-pyrazol-3-yl]carbonyl}amino)-2-adamantanecarboxylic acid [ACD/IUPAC Name]
Acide 2-({[5-{2,6-bis[(3H3)méthyloxy]phényl}-1-(7-chloro-4-quinoléinyl)-1H-pyrazol-3-yl]carbonyl}amino)-2-adamantanecarboxylique [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-2-carboxylic acid, 2-[[[5-[2,6-bis(methyl-t3-oxy)phenyl]-1-(7-chloro-4-quinolinyl)-1H-pyrazol-3-yl]carbonyl]amino]- [ACD/Index Name]
[3H]meclinertant
[3H]reminertant
[3H]SR-48692
[3H]-SR48692
[3H]-SR48692|[3H]reminertant|[3H]SR-48692
[³H]meclinertant
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

SR-48692 [DBID]

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

Density:
Boiling Point: 781.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.2±3.0 kJ/mol
Flash Point: 426.2±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.55
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 9.90
ACD/KOC (pH 5.5): 43.49
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.67
Polar Surface Area: 116 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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