ChemSpider 2D Image | nacubactam | C9H16N4O7S

nacubactam

  • Molecular FormulaC9H16N4O7S
  • Average mass324.311 Da
  • Monoisotopic mass324.073975 Da
  • ChemSpider ID58827979

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,5R)-N-(2-Aminoethoxy)-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octan-2-carboxamid [German] [ACD/IUPAC Name]
(2S,5R)-N-(2-Aminoethoxy)-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide [ACD/IUPAC Name]
(2S,5R)-N-(2-Aminoéthoxy)-7-oxo-6-(sulfooxy)-1,6-diazabicyclo[3.2.1]octane-2-carboxamide [French] [ACD/IUPAC Name]
1,6-Diazabicyclo[3.2.1]octane-2-carboxamide, N-(2-aminoethoxy)-7-oxo-6-(sulfooxy)-, (2S,5R)- [ACD/Index Name]
1452458-86-4 [RN]
832O37V7MZ
nacubactam [INN] [USAN]
nacubactam [French] [INN]
Nacubactam [Spanish] [INN]
nacubactamum [Latin] [INN]
More...

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

10300 [DBID]
RG6080 [DBID]
RO7079901 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.645
Molar Refractivity: 68.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.82
ACD/LogD (pH 5.5): -5.66
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 91.5±5.0 dyne/cm
Molar Volume: 189.4±5.0 cm3

Click to predict properties on the Chemicalize site


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