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Search term: YWOVCUCLMADHSH (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-Benzyl-N-{3-[3-(1-piperidinylmethyl)phenoxy]propyl}thieno[3,4-d][1,2]thiazol-3-amine 1,1-dioxide | C27H31N3O3S2

N-Benzyl-N-{3-[3-(1-piperidinylmethyl)phenoxy]propyl}thieno[3,4-d][1,2]thiazol-3-amine 1,1-dioxide

  • Molecular FormulaC27H31N3O3S2
  • Average mass509.683 Da
  • Monoisotopic mass509.180695 Da
  • ChemSpider ID113910

More details:

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

1,1-Dioxyde de N-benzyl-N-{3-[3-(1-pipéridinylméthyl)phénoxy]propyl}thiéno[3,4-d][1,2]thiazol-3-amine [French] [ACD/IUPAC Name]
N-(Phenylmethyl)-N-(3-(3-(1-piperidinylmethyl)phenoxy)propyl)thieno(3,4-d)isothiazol-3-amine 1,1-dioxide
N-Benzyl-N-{3-[3-(1-piperidinylmethyl)phenoxy]propyl}thieno[3,4-d][1,2]thiazol-3-amin-1,1-dioxid [German] [ACD/IUPAC Name]
N-Benzyl-N-{3-[3-(1-piperidinylmethyl)phenoxy]propyl}thieno[3,4-d][1,2]thiazol-3-amine 1,1-dioxide [ACD/IUPAC Name]
Thieno(3,4-d)isothiazol-3-amine, N-(phenylmethyl)-N-(3-(3-(1-piperidinylmethyl)phenoxy)propyl)-, 1,1-dioxide
Thieno[3,4-d]isothiazol-3-amine, N-(phenylmethyl)-N-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]-, 1,1-dioxide [ACD/Index Name]
104221-86-5 [RN]
THIENO[3,4-D]ISOTHIAZOL-3-AMINE,N-BENZYL-N-(3-(3-(1-PIPERIDIN YLMETHYL)PHENOXY)PROPYL)-,1,1-DIOXIDE
Wy-46,499

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

Wy 46499 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 684.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.4±3.0 kJ/mol
Flash Point: 367.8±34.3 °C
Index of Refraction: 1.657
Molar Refractivity: 144.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 1.10
ACD/KOC (pH 5.5): 5.41
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 7.4): 26.34
ACD/KOC (pH 7.4): 130.15
Polar Surface Area: 99 Å2
Polarizability: 57.1±0.5 10-24cm3
Surface Tension: 53.7±7.0 dyne/cm
Molar Volume: 391.8±7.0 cm3

Click to predict properties on the Chemicalize site


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