ChemSpider 2D Image | (2R,3S,4S)-3-Acetamido-4-carbamimidamido-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid (non-preferred name) | C14H23N5O5

(2R,3S,4S)-3-Acetamido-4-carbamimidamido-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid (non-preferred name)

  • Molecular FormulaC14H23N5O5
  • Average mass341.363 Da
  • Monoisotopic mass341.169922 Da
  • ChemSpider ID62423576

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R,3S,4S)-3-Acetamido-4-{[amino(iminio)methyl]amino}-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylat (non-preferred name) [German] [ACD/IUPAC Name]
(2R,3S,4S)-3-Acetamido-4-{[amino(iminio)methyl]amino}-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylate (non-preferred name) [ACD/IUPAC Name]
(2R,3S,4S)-3-Acétamido-4-{[amino(iminio)méthyl]amino}-2-(diéthylcarbamoyl)-3,4-dihydro-2H-pyrane-6-carboxylate (non-preferred name) [French] [ACD/IUPAC Name]
(2R,3S,4S)-3-Acetamido-4-carbamimidamido-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carbonsäure (non-preferred name) [German] [ACD/IUPAC Name]
(2R,3S,4S)-3-Acetamido-4-carbamimidamido-2-(diethylcarbamoyl)-3,4-dihydro-2H-pyran-6-carboxylic acid (non-preferred name) [ACD/IUPAC Name]
Acide (2R,3S,4S)-3-acétamido-4-carbamimidamido-2-(diéthylcarbamoyl)-3,4-dihydro-2H-pyrane-6-carboxylique (non-preferred name) [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.617
Molar Refractivity: 82.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.72
ACD/LogD (pH 5.5): -4.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 158 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 56.4±7.0 dyne/cm
Molar Volume: 236.3±7.0 cm3

Click to predict properties on the Chemicalize site


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