ChemSpider 2D Image | N-({4-[4-(2-Methyl-1H-imidazol-1-yl)butyl]phenyl}acetyl)-L-seryl-N-(2-cyclohexylethyl)-L-lysinamide | C33H52N6O4

N-({4-[4-(2-Methyl-1H-imidazol-1-yl)butyl]phenyl}acetyl)-L-seryl-N-(2-cyclohexylethyl)-L-lysinamide

  • Molecular FormulaC33H52N6O4
  • Average mass596.804 Da
  • Monoisotopic mass596.405029 Da
  • ChemSpider ID393759
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

L-Lysinamide, N-[2-[4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl]acetyl]-L-seryl-N-(2-cyclohexylethyl)- [ACD/Index Name]
N-({4-[4-(2-Methyl-1H-imidazol-1-yl)butyl]phenyl}acetyl)-L-seryl-N-(2-cyclohexylethyl)-L-lysinamid [German] [ACD/IUPAC Name]
N-({4-[4-(2-Methyl-1H-imidazol-1-yl)butyl]phenyl}acetyl)-L-seryl-N-(2-cyclohexylethyl)-L-lysinamide [ACD/IUPAC Name]
N-(2-{4-[4-(2-Méthyl-1H-imidazol-1-yl)butyl]phényl}acétyl)-L-séryl-N-(2-cyclohexyléthyl)-L-lysinamide [French] [ACD/IUPAC Name]
(2S)-6-AMINO-N-(2-CYCLOHEXYLETHYL)-2-[(2S)-3-HYDROXY-2-(2-{4-[4-(2-METHYLIMIDAZOL-1-YL)BUTYL]PHENYL}ACETAMIDO)PROPANAMIDO]HEXANAMIDE
[CYCLOHEXYLETHYL]-[[[[4-[2-METHYL-1-IMIDAZOLYL-BUTYL]PHENYL]ACETYL]-SERYL]-LYSINYL]-AMINE
164931-25-3 [RN]
L-Lysinamide, N-((4-(4-(2-methyl-1H-imidazol-1-yl)butyl)phenyl)acetyl)-L-seryl-N1-(2-cyclohexylethyl)-
L-Lysinamide, N-[[4-[4-(2-methyl-1H-imidazol-1-yl)butyl]phenyl]acetyl]-L-seryl-N1-(2-cyclohexylethyl)-
MIM

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

AIDS032219 [DBID]
AIDS-032219 [DBID]
LI7 [DBID]
SC 58272 [DBID]
SC-58272 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 933.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 142.3±3.0 kJ/mol
Flash Point: 518.4±34.3 °C
Index of Refraction: 1.600
Molar Refractivity: 168.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 3.14
ACD/LogD (pH 5.5): -0.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 151 Å2
Polarizability: 66.7±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 491.9±7.0 cm3

Click to predict properties on the Chemicalize site






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