ChemSpider 2D Image | (1R,5R,13R,14S,16R)-18-Hydroxy-10-methoxy-4-methyl-12,15-dioxa-4-azahexacyclo[9.7.1.0~1,13~.0~5,18~.0~7,19~.0~14,16~]nonadeca-7(19),8,10-triene-14-carboxamide | C19H22N2O5

(1R,5R,13R,14S,16R)-18-Hydroxy-10-methoxy-4-methyl-12,15-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.014,16]nonadeca-7(19),8,10-triene-14-carboxamide

  • Molecular FormulaC19H22N2O5
  • Average mass358.388 Da
  • Monoisotopic mass358.152863 Da
  • ChemSpider ID30658447

  • defined stereocentres - 5 of 6 defined stereocentres

More details:

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

(1R,5R,13R,14S,16R)-18-Hydroxy-10-methoxy-4-methyl-12,15-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.014,16]nonadeca-7(19),8,10-trien-14-carboxamid [German] [ACD/IUPAC Name]
(1R,5R,13R,14S,16R)-18-Hydroxy-10-methoxy-4-methyl-12,15-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.014,16]nonadeca-7(19),8,10-triene-14-carboxamide [ACD/IUPAC Name]
(1R,5R,13R,14S,16R)-18-Hydroxy-10-méthoxy-4-méthyl-12,15-dioxa-4-azahexacyclo[9.7.1.01,13.05,18.07,19.014,16]nonadéca-7(19),8,10-triène-14-carboxamide [French] [ACD/IUPAC Name]
4,8-Methano-5H-benzofuro[3,2-e]oxireno[g]isoquinoline-10a(10bH)-carboxamide, 6,7,8,8a,9,9a-hexahydro-8a-hydroxy-1-methoxy-7-methyl-, (4bR,8R,9aR,10aS,10bR)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 619.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 328.3±31.5 °C
Index of Refraction: 1.709
Molar Refractivity: 91.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.09
ACD/LogD (pH 5.5): -1.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.49
Polar Surface Area: 98 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 78.0±5.0 dyne/cm
Molar Volume: 233.4±5.0 cm3

Click to predict properties on the Chemicalize site


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