ChemSpider 2D Image | N~2~-(3,4-Dichlorobenzoyl)-N-(3-methoxypropyl)-N-pentyl-L-alpha-glutamine | C21H30Cl2N2O5

N2-(3,4-Dichlorobenzoyl)-N-(3-methoxypropyl)-N-pentyl-L-α-glutamine

  • Molecular FormulaC21H30Cl2N2O5
  • Average mass461.379 Da
  • Monoisotopic mass460.153168 Da
  • ChemSpider ID26602600

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

N2-(3,4-Dichlorbenzoyl)-N-(3-methoxypropyl)-N-pentyl-L-α-glutamin [German] [ACD/IUPAC Name]
N2-(3,4-Dichlorobenzoyl)-N-(3-methoxypropyl)-N-pentyl-L-α-glutamine [ACD/IUPAC Name]
N2-(3,4-Dichlorobenzoyl)-N-(3-méthoxypropyl)-N-pentyl-L-α-glutamine [French] [ACD/IUPAC Name]
(4R)-4-[(3,4-dichlorobenzoyl)amino]-5-(3-methoxypropyl-pentylamino)-5-oxopentanoic acid
(4R)-4-[(3,4-dichlorobenzoyl)amino]-5-(3-methoxypropyl-pentyl-amino)-5-oxo-pentanoic acid
(4R)-4-[(3,4-dichlorophenyl)carbonylamino]-5-(3-methoxypropyl-pentyl-amino)-5-oxo-pentanoic acid
(4R)-4-[[(3,4-dichlorophenyl)-oxomethyl]amino]-5-(3-methoxypropyl-pentylamino)-5-oxopentanoic acid
(4R)-5-(amyl-(3-methoxypropyl)amino)-4-[(3,4-dichlorobenzoyl)amino]-5-keto-valeric acid
(R)-4-(3,4-Dichlorobenzamido)-N-(3-methoxypropyl)-N-pentylglutaramic acid
107097-80-3 [RN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CR-2017 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 632.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.3±3.0 kJ/mol
Flash Point: 336.1±31.5 °C
Index of Refraction: 1.538
Molar Refractivity: 116.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 85.22
ACD/KOC (pH 5.5): 416.45
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 1.35
ACD/KOC (pH 7.4): 6.58
Polar Surface Area: 96 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 46.9±3.0 dyne/cm
Molar Volume: 374.0±3.0 cm3

Click to predict properties on the Chemicalize site


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