3H-pyrrolo[2,3-d]pyrimidin-4(7H)-one

3H-pyrrolo[2,3-d]pyrimidin-4(7H)-one structure
CAS番号3680-71-5
分子式C6H5N3O
分子量135.12 g/mol
外観White to off-white solid
融点345-348 °C
SMILESO=c1[nH]cnc2[nH]ccc12
InChIKeyFBMZEITWVNHWJW-UHFFFAOYSA-N
製品説明4-Hydroxypyrrolo[2,3-d]pyrimidine, a purine base bioisostere. The 4-hydroxyl (lactam) can condense with amines for glycosidic bond formation in nucleoside antiviral synthesis.
用途Pharmaceutical intermediate; pyrrolopyrimidine; nucleoside intermediate

計算・予測物性

推定沸点473.1 °C (予測値)
推定密度1.62 g/cm³ (予測値)