5-[6-(Benzylamino)-9H-Purin-9-Yl]-N-Ethyl-3,4-Dihydroxytetrahydro-2-Furancarboxamide
[CAS# 152918-32-6]

Identification

• Name: 5-[6-(Benzylamino)-9H-Purin-9-Yl]-N-Ethyl-3,4-Dihydroxytetrahydro-2-Furancarboxamide
• Synonyms: 5-(6-Benzylamino-purin-9-yl)-3,4-dihydroxy-tetrahydro-furan-2-carboxylic acid ethylamide; N6-Benzyl-5'-ethylcarboxamido Adenosine; N6-Benzyl-5'-N-ethylcarboxamidoadenosine
• Molecular Formula: C₁₉H₂₂N₆O₄
• Molecular Weight: 398.42
• CAS Registry Number: 152918-32-6
• SMILES: O=C(NCC)C4OC(n2cnc1c(ncnc12)NCc3ccccc3)C(O)C4O
• InChI: 1S/C19H22N6O4/c1-2-20-18(28)15-13(26)14(27)19(29-15)25-10-24-12-16(22-9-23-17(12)25)21-8-11-6-4-3-5-7-11/h3-7,9-10,13-15,19,26-27H,2,8H2,1H3,(H,20,28)(H,21,22,23)
• InChIKey: VVHDYJFDZYHAMR-UHFFFAOYSA-N

Properties

• Density: 1.556g/cm³ (Cal.)
• Refractive index: 1.737 (Cal.)