Found 1 result

Search term: LHFRREYTABIJEO-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide | C26H27N5O2S

N-(6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide

  • Molecular FormulaC26H27N5O2S
  • Average mass473.590 Da
  • Monoisotopic mass473.188538 Da
  • ChemSpider ID23313142

More details:

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

5-Isoxazolecarboxamide, N-[6-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-2,3-dihydro-1H-inden-1-yl]- [ACD/Index Name]
N-(6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-2,3-dihydro-1H-inden-1-yl)-1,2-oxazol-5-carboxamid [German] [ACD/IUPAC Name]
N-(6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide [ACD/IUPAC Name]
N-(6-{2-[4-(1,2-Benzothiazol-3-yl)-1-pipérazinyl]éthyl}-2,3-dihydro-1H-indén-1-yl)-1,2-oxazole-5-carboxamide [French] [ACD/IUPAC Name]
N-(6-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide
CHEMBL251834
N-(6-(2-(4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)ethyl)-2,3-dihydro-1H-inden-1-yl)isoxazole-5-carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 669.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.4±3.0 kJ/mol
Flash Point: 358.9±31.5 °C
Index of Refraction: 1.708
Molar Refractivity: 133.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 0.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 37.08
ACD/KOC (pH 7.4): 266.50
Polar Surface Area: 103 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 75.1±5.0 dyne/cm
Molar Volume: 343.0±5.0 cm3

Click to predict properties on the Chemicalize site


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