ChemSpider 2D Image | 1-Adamantan-1-yl-3-(2-{[(6-chloro-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]sulfonyl}ethyl)thiourea | C19H27ClN4O2S3

1-Adamantan-1-yl-3-(2-{[(6-chloro-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]sulfonyl}ethyl)thiourea

  • Molecular FormulaC19H27ClN4O2S3
  • Average mass475.091 Da
  • Monoisotopic mass474.098450 Da
  • ChemSpider ID28686049

More details:

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

1-Adamantan-1-yl-3-(2-{[(6-chlor-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]sulfonyl}ethyl)thioharnstoff [German] [ACD/IUPAC Name]
1-Adamantan-1-yl-3-(2-{[(6-chloro-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)methyl]sulfonyl}ethyl)thiourea [ACD/IUPAC Name]
1-Adamantan-1-yl-3-(2-{[(6-chloro-2,3-dihydroimidazo[2,1-b][1,3]thiazol-5-yl)méthyl]sulfonyl}éthyl)thiourée [French] [ACD/IUPAC Name]
Thiourea, N-[2-[[(6-chloro-2,3-dihydroimidazo[2,1-b]thiazol-5-yl)methyl]sulfonyl]ethyl]-N'-tricyclo[3.3.1.13,7]dec-1-yl- [ACD/Index Name]
1-(Adamant-1-yl)-3-(2-(6-chloro-2,3-dihydroimidazo(2,1-b)thiazol-5-ylmethylsulfonyl)ethyl)thiourea
152218-06-9 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 713.5±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.3±3.0 kJ/mol
Flash Point: 385.3±35.7 °C
Index of Refraction: 1.812
Molar Refractivity: 120.5±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.27
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 84.63
ACD/KOC (pH 5.5): 834.24
ACD/LogD (pH 7.4): 2.84
ACD/BCF (pH 7.4): 84.66
ACD/KOC (pH 7.4): 834.55
Polar Surface Area: 142 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 71.4±7.0 dyne/cm
Molar Volume: 278.8±7.0 cm3

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