Found 1 result

Search term: JBLVGKQIAQNLEM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | N-(3-Methoxybenzyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-2-carboxamide | C15H13N3O3S

N-(3-Methoxybenzyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-2-carboxamide

  • Molecular FormulaC15H13N3O3S
  • Average mass315.347 Da
  • Monoisotopic mass315.067749 Da
  • ChemSpider ID35034580

More details:

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

N-(3-Methoxybenzyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-carboxamid [German] [ACD/IUPAC Name]
N-(3-Methoxybenzyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-2-carboxamide [ACD/IUPAC Name]
N-(3-Méthoxybenzyl)-4-oxo-3,4-dihydrothiéno[2,3-d]pyrimidine-2-carboxamide [French] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidine-2-carboxamide, 3,4-dihydro-N-[(3-methoxyphenyl)methyl]-4-oxo- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3337881/
WLL

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.699
Molar Refractivity: 83.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 5.53
ACD/KOC (pH 5.5): 118.32
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 5.31
ACD/KOC (pH 7.4): 113.62
Polar Surface Area: 108 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 58.4±7.0 dyne/cm
Molar Volume: 217.4±7.0 cm3

Click to predict properties on the Chemicalize site


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