Found 1 result

Search term: GUWMTHIBQGCCPK (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 2-{(2E)-2-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propen-1-ylidene]hydrazino}adenosine | C20H23N7O6

2-{(2E)-2-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propen-1-ylidene]hydrazino}adenosine

  • Molecular FormulaC20H23N7O6
  • Average mass457.440 Da
  • Monoisotopic mass457.170990 Da
  • ChemSpider ID28941628

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2-{(2E)-2-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propen-1-yliden]hydrazino}adenosin [German] [ACD/IUPAC Name]
2-{(2E)-2-[(2E)-3-(4-Hydroxy-3-methoxyphenyl)-2-propen-1-ylidene]hydrazino}adenosine [ACD/IUPAC Name]
2-{(2E)-2-[(2E)-3-(4-Hydroxy-3-méthoxyphényl)-2-propén-1-ylidène]hydrazino}adénosine [French] [ACD/IUPAC Name]
Adenosine, 2-[(2E)-2-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propen-1-ylidene]hydrazinyl]- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL2113559/

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

Density: 1.7±0.1 g/cm3
Boiling Point: 868.4±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.2±3.0 kJ/mol
Flash Point: 479.0±37.1 °C
Index of Refraction: 1.756
Molar Refractivity: 111.7±0.5 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.58
ACD/LogD (pH 5.5): -0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.05
ACD/LogD (pH 7.4): 0.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 23.47
Polar Surface Area: 193 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 74.6±7.0 dyne/cm
Molar Volume: 272.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement