ChemSpider 2D Image | Pomaglumetad methionil | C12H18N2O7S2

Pomaglumetad methionil

  • Molecular FormulaC12H18N2O7S2
  • Average mass366.410 Da
  • Monoisotopic mass366.055542 Da
  • ChemSpider ID28530777
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

Pomaglumetad methionil [INN] [USAN]
POMAGLUMETAD METHIONIL ANHYDROUS
(1R,4S,5S,6S)-4-(L-Methionylamino)-2-thiabicyclo[3.1.0]hexan-4,6-dicarbonsäure-2,2-dioxid [German] [ACD/IUPAC Name]
(1R,4S,5S,6S)-4-(L-Methionylamino)-2-thiabicyclo[3.1.0]hexane-4,6-dicarboxylic acid 2,2-dioxide [ACD/IUPAC Name]
2-Thiabicyclo[3.1.0]hexane-4,6-dicarboxylic acid, 4-[[(2S)-2-amino-4-(methylthio)-1-oxobutyl]amino]-, 2,2-dioxide, (1R,4S,5S,6S)- [ACD/Index Name]
3V85EZ3KFQ
635318-55-7 [RN]
9404
Acide (1R,4S,5S,6S) 2,2-dioxyde de 4-(L-méthionylamino)-2-thiabicyclo[3.1.0]hexane-4,6-dicarboxylique [French] [ACD/IUPAC Name]
pomaglumétad méthionil [French] [INN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

LY2140023 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 773.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 122.5±6.0 kJ/mol
Flash Point: 421.7±32.9 °C
Index of Refraction: 1.647
Molar Refractivity: 81.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -1.82
ACD/LogD (pH 5.5): -5.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.72
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 198 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 86.3±5.0 dyne/cm
Molar Volume: 222.9±5.0 cm3

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