ChemSpider 2D Image | (2S)-N',N'-Dibutyl-2-{(3R)-3-[(3-cyclohexylpropyl)amino]-2-oxo-1-pyrrolidinyl}pentanehydrazide | C26H50N4O2

(2S)-N',N'-Dibutyl-2-{(3R)-3-[(3-cyclohexylpropyl)amino]-2-oxo-1-pyrrolidinyl}pentanehydrazide

  • Molecular FormulaC26H50N4O2
  • Average mass450.701 Da
  • Monoisotopic mass450.393372 Da
  • ChemSpider ID23158086

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-N',N'-Dibutyl-2-{(3R)-3-[(3-cyclohexylpropyl)amino]-2-oxo-1-pyrrolidinyl}pentanehydrazide [ACD/IUPAC Name]
(2S)-N',N'-Dibutyl-2-{(3R)-3-[(3-cyclohexylpropyl)amino]-2-oxo-1-pyrrolidinyl}pentanehydrazide [French] [ACD/IUPAC Name]
(2S)-N',N'-Dibutyl-2-{(3R)-3-[(3-cyclohexylpropyl)amino]-2-oxo-1-pyrrolidinyl}pentanhydrazid [German] [ACD/IUPAC Name]
(2S)-N',N'-dibutyl-2-{(3R)-3-[(3-cyclohexylpropyl)amino]-2-oxopyrrolidin-1-yl}pentanehydrazide
1-Pyrrolidineacetic acid, 3-[(3-cyclohexylpropyl)amino]-2-oxo-α-propyl-, 2,2-dibutylhydrazide, (αS,3R)- [ACD/Index Name]
(S)-2-[(R)-3-(3-Cyclohexyl-propylamino)-2-oxo-pyrrolidin-1-yl]-pentanoic acid N',N'-dibutyl-hydrazide
CHEMBL442745
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL442745/

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

Density: 1.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.519
Molar Refractivity: 133.6±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 6.22
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 19.78
ACD/KOC (pH 5.5): 58.99
ACD/LogD (pH 7.4): 4.50
ACD/BCF (pH 7.4): 1020.07
ACD/KOC (pH 7.4): 3042.49
Polar Surface Area: 65 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 42.8±5.0 dyne/cm
Molar Volume: 440.4±5.0 cm3

Click to predict properties on the Chemicalize site


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