ChemSpider 2D Image | (10R,11S)-10,11-Dihydroxy-14-[(6-oxo-1,6-dihydro-3-pyridazinyl)carbonyl]-3-(2-pyridinylmethyl)-8-oxa-3,14-diazaspiro[5.12]octadecan-7-one | C26H35N5O6

(10R,11S)-10,11-Dihydroxy-14-[(6-oxo-1,6-dihydro-3-pyridazinyl)carbonyl]-3-(2-pyridinylmethyl)-8-oxa-3,14-diazaspiro[5.12]octadecan-7-one

  • Molecular FormulaC26H35N5O6
  • Average mass513.586 Da
  • Monoisotopic mass513.258728 Da
  • ChemSpider ID80824648

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(10R,11S)-10,11-Dihydroxy-14-[(6-oxo-1,6-dihydro-3-pyridazinyl)carbonyl]-3-(2-pyridinylmethyl)-8-oxa-3,14-diazaspiro[5.12]octadecan-7-on [German] [ACD/IUPAC Name]
(10R,11S)-10,11-Dihydroxy-14-[(6-oxo-1,6-dihydro-3-pyridazinyl)carbonyl]-3-(2-pyridinylmethyl)-8-oxa-3,14-diazaspiro[5.12]octadecan-7-one [ACD/IUPAC Name]
(10R,11S)-10,11-Dihydroxy-14-[(6-oxo-1,6-dihydro-3-pyridazinyl)carbonyl]-3-(2-pyridinylméthyl)-8-oxa-3,14-diazaspiro[5.12]octadécan-7-one [French] [ACD/IUPAC Name]
8-Oxa-3,14-diazaspiro[5.12]octadecan-7-one, 14-[(1,6-dihydro-6-oxo-3-pyridazinyl)carbonyl]-10,11-dihydroxy-3-(2-pyridinylmethyl)-, (10R,11S)- [ACD/Index 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: 1.652
Molar Refractivity: 135.4±0.5 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: -1.68
ACD/LogD (pH 5.5): -2.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.50
Polar Surface Area: 145 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 59.5±7.0 dyne/cm
Molar Volume: 370.5±7.0 cm3

Click to predict properties on the Chemicalize site


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