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Search term: QLWUWVNGTYIEIX-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-1-indanamine | C22H26N4S

6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-1-indanamine

  • Molecular FormulaC22H26N4S
  • Average mass378.534 Da
  • Monoisotopic mass378.187805 Da
  • ChemSpider ID23313098

More details:

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

1H-Inden-1-amine, 6-[2-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]ethyl]-2,3-dihydro- [ACD/Index Name]
6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-1-indanamin [German] [ACD/IUPAC Name]
6-{2-[4-(1,2-Benzothiazol-3-yl)-1-piperazinyl]ethyl}-1-indanamine [ACD/IUPAC Name]
6-{2-[4-(1,2-Benzothiazol-3-yl)-1-pipérazinyl]éthyl}-1-indanamine [French] [ACD/IUPAC Name]
6-{2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl}-2,3-dihydro-1H-inden-1-amine
6-(2-(4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)ethyl)-2,3-dihydro-1H-inden-1-amine
CHEMBL404000
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL404000/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 502.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 257.4±30.1 °C
Index of Refraction: 1.671
Molar Refractivity: 113.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): -1.43
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.40
Polar Surface Area: 74 Å2
Polarizability: 45.1±0.5 10-24cm3
Surface Tension: 58.2±3.0 dyne/cm
Molar Volume: 304.5±3.0 cm3

Click to predict properties on the Chemicalize site


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