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Search term: VAUYIWWHFJNKTF-ROUUACIJSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2S)-2-Amino-N-{(1S)-1-cyclohexyl-2-[(4-methylphenyl)amino]-2-oxoethyl}-4-(methylselanyl)butanamide | C20H31N3O2Se

(2S)-2-Amino-N-{(1S)-1-cyclohexyl-2-[(4-methylphenyl)amino]-2-oxoethyl}-4-(methylselanyl)butanamide

  • Molecular FormulaC20H31N3O2Se
  • Average mass424.439 Da
  • Monoisotopic mass425.158142 Da
  • ChemSpider ID35034908

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-2-Amino-N-{(1S)-1-cyclohexyl-2-[(4-methylphenyl)amino]-2-oxoethyl}-4-(methylselanyl)butanamid [German] [ACD/IUPAC Name]
(2S)-2-Amino-N-{(1S)-1-cyclohexyl-2-[(4-methylphenyl)amino]-2-oxoethyl}-4-(methylselanyl)butanamide [ACD/IUPAC Name]
(2S)-2-Amino-N-{(1S)-1-cyclohexyl-2-[(4-méthylphényl)amino]-2-oxoéthyl}-4-(méthylsélanyl)butanamide [French] [ACD/IUPAC Name]
Cyclohexaneacetamide, α-[[(2S)-2-amino-4-(methylseleno)-1-oxobutyl]amino]-N-(4-methylphenyl)-, (αS)- [ACD/Index Name]
2QW

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

Density:
Boiling Point: 646.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 344.5±31.5 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.59
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 19.38
ACD/KOC (pH 7.4): 253.77
Polar Surface Area: 84 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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