Found 1 result

Search term: CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1C(=O)N(C)C (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 1-{[(5R,6S)-5,6-Bis(4-chlorophenyl)-3-isopropyl-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]carbonyl}-N,N-dimethyl-L-prolinamide | C29H32Cl2N4O2S

1-{[(5R,6S)-5,6-Bis(4-chlorophenyl)-3-isopropyl-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]carbonyl}-N,N-dimethyl-L-prolinamide

  • Molecular FormulaC29H32Cl2N4O2S
  • Average mass571.561 Da
  • Monoisotopic mass570.162292 Da
  • ChemSpider ID29397987

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

1-{[(5R,6S)-5,6-Bis(4-chlorophenyl)-3-isopropyl-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]carbonyl}-N,N-dimethyl-L-prolinamide [ACD/IUPAC Name]
1-{[(5R,6S)-5,6-Bis(4-chlorophényl)-3-isopropyl-6-méthyl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]carbonyl}-N,N-diméthyl-L-prolinamide [French] [ACD/IUPAC Name]
1-{[(5r,6s)-5,6-Bis(4-Chlorophenyl)-6-Methyl-3-(Propan-2-Yl)-5,6-Dihydroimidazo[2,1-B][1,3]thiazol-2-Yl]carbonyl}-N,N-Dimethyl-L-Prolinamide
1-{[(5R,6S)-5,6-Bis(4-chlorphenyl)-3-isopropyl-6-methyl-5,6-dihydroimidazo[2,1-b][1,3]thiazol-2-yl]carbonyl}-N,N-dimethyl-L-prolinamid [German] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 1-[[(5R,6S)-5,6-bis(4-chlorophenyl)-5,6-dihydro-6-methyl-3-(1-methylethyl)imidazo[2,1-b]thiazol-2-yl]carbonyl]-N,N-dimethyl-, (2S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 706.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.3±3.0 kJ/mol
Flash Point: 380.9±35.7 °C
Index of Refraction: 1.665
Molar Refractivity: 156.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 5.00
ACD/BCF (pH 5.5): 3692.93
ACD/KOC (pH 5.5): 12435.87
ACD/LogD (pH 7.4): 5.00
ACD/BCF (pH 7.4): 3706.02
ACD/KOC (pH 7.4): 12479.95
Polar Surface Area: 82 Å2
Polarizability: 62.1±0.5 10-24cm3
Surface Tension: 49.3±7.0 dyne/cm
Molar Volume: 422.0±7.0 cm3

Click to predict properties on the Chemicalize site


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