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Search term: QDWILIOJTHGVHN-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 4-Oxo-9-(1H-tetrazol-5-ylmethyl)-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazine-2-carboxylic acid | C16H11N7O3

4-Oxo-9-(1H-tetrazol-5-ylmethyl)-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazine-2-carboxylic acid

  • Molecular FormulaC16H11N7O3
  • Average mass349.304 Da
  • Monoisotopic mass349.092346 Da
  • ChemSpider ID23123152

More details:

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

10H-Imidazo[1,2-a]indeno[1,2-e]pyrazine-2-carboxylic acid, 4-hydroxy-9-(2H-tetrazol-5-ylmethyl)- [ACD/Index Name]
4-Oxo-9-(1H-tetrazol-5-ylmethyl)-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazin-2-carbonsäure [German] [ACD/IUPAC Name]
4-Oxo-9-(1H-tetrazol-5-ylmethyl)-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazine-2-carboxylic acid [ACD/IUPAC Name]
Acide 4-oxo-9-(1H-tétrazol-5-ylméthyl)-5,10-dihydro-4H-imidazo[1,2-a]indéno[1,2-e]pyrazine-2-carboxylique [French] [ACD/IUPAC Name]
4-Oxo-9-(2H-tetrazol-5-ylmethyl)-5,10-dihydro-4H-imidazo[1,2-a]indeno[1,2-e]pyrazine-2-carboxylic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL279018/

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

Density: 2.0±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.986
Molar Refractivity: 88.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 0.24
ACD/LogD (pH 5.5): -3.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 142 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 102.6±7.0 dyne/cm
Molar Volume: 178.4±7.0 cm3

Click to predict properties on the Chemicalize site


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