Found 7 results

Search term: CLEDZMPJHBBTNZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-[(4R)-4-Hydroxy-1,6-diphenyl-5-{[(1,3-thiazol-5-ylmethoxy)carbonyl]amino}-2-hexanyl]-N~2~-[{[2-(2-hydroxy-2-propanyl)-1,3-thiazol-4-yl]methyl}(methyl)carbamoyl]-D-valinamide | C37H48N6O6S2

N-[(4R)-4-Hydroxy-1,6-diphenyl-5-{[(1,3-thiazol-5-ylmethoxy)carbonyl]amino}-2-hexanyl]-N2-[{[2-(2-hydroxy-2-propanyl)-1,3-thiazol-4-yl]methyl}(methyl)carbamoyl]-D-valinamide

  • Molecular FormulaC37H48N6O6S2
  • Average mass736.944 Da
  • Monoisotopic mass736.307678 Da
  • ChemSpider ID29790232

  • defined stereocentres - 2 of 4 defined stereocentres

More details:

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

Carbamic acid, N-[(2R)-2-hydroxy-4-[[(2R)-2-[[[[[2-(1-hydroxy-1-methylethyl)-4-thiazolyl]methyl]methylamino]carbonyl]amino]-3-methyl-1-oxobutyl]amino]-5-phenyl-1-(phenylmethyl)pentyl]-, 5-thiazolylmet hyl ester [ACD/Index Name]
N-[(4R)-4-Hydroxy-1,6-diphenyl-5-{[(1,3-thiazol-5-ylmethoxy)carbonyl]amino}-2-hexanyl]-N2-[{[2-(2-hydroxy-2-propanyl)-1,3-thiazol-4-yl]methyl}(methyl)carbamoyl]-D-valinamid [German] [ACD/IUPAC Name]
N-[(4R)-4-Hydroxy-1,6-diphenyl-5-{[(1,3-thiazol-5-ylmethoxy)carbonyl]amino}-2-hexanyl]-N2-[{[2-(2-hydroxy-2-propanyl)-1,3-thiazol-4-yl]methyl}(methyl)carbamoyl]-D-valinamide [ACD/IUPAC Name]
N-[(4R)-4-Hydroxy-1,6-diphényl-5-{[(1,3-thiazol-5-ylméthoxy)carbonyl]amino}-2-hexanyl]-N2-[{[2-(2-hydroxy-2-propanyl)-1,3-thiazol-4-yl]méthyl}(méthyl)carbamoyl]-D-valinamide [French] [ACD/IUPAC Name]
[5S-(5R*,8R*,10R*,11R*)]-10-Hydroxy-1-[2-(1-hydroxy-1-methylethyl)-4-thiazolyl]-2-methyl-5-(1-methylethyl)-3,6-dioxo-8,11-bis(phenylmethyl)-
[5S-(5R*,8R*,10R*,11R*)]-10-Hydroxy-1-[2-(1-hydroxy-1-methylethyl)-4-thiazolyl]-2-methyl-5-(1-methylethyl)-3,6-dioxo-8,11-bis(phenylmethyl)-2,4,7,12-tetraazatridecan-13-oic Acid 5-Thiazolylmethyl Ester
176655-56-4 [RN]
Hydroxy ritonavir

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

Density: 1.3±0.1 g/cm3
Boiling Point: 981.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 149.8±3.0 kJ/mol
Flash Point: 547.2±34.3 °C
Index of Refraction: 1.607
Molar Refractivity: 200.0±0.3 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 3
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 864.24
ACD/KOC (pH 5.5): 4398.57
ACD/LogD (pH 7.4): 4.17
ACD/BCF (pH 7.4): 864.54
ACD/KOC (pH 7.4): 4400.12
Polar Surface Area: 222 Å2
Polarizability: 79.3±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 579.4±3.0 cm3

Click to predict properties on the Chemicalize site


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