Ro 5-3663

化合物

Ro 5-3663是一種有機化合物,化學式為C10H10N2O,其化學名為1,3-二氫-5-甲基-2H-1,4-苯二氮䓬-2-酮。它可以2'-氨基苯乙酮N-叔丁氧羰基甘氨酸(或N-芴甲氧羰基甘氨酸[1])為原料反應製得。[2]它和苯甲醇(或異丙醇)、三丁基膦DIAD三氯甲烷中反應,可以得到1-苄基-Ro 5-3663或1-異丙基-Ro 5-3663。[1]

Ro 5-3663
別名 5-甲基-1H-苯並[e][1,4]二氮雜環庚三烯-2(3H)-酮
識別
CAS號 70656-87-0  checkY
PubChem 135432558
SMILES
 
  • O=C1NC=2C=CC=CC2C(=NC1)C
性質
化學式 C10H10N2O
摩爾質量 174.2 g·mol−1
外觀 白色固體[1]
熔點 178~181 °C[1]
若非註明,所有數據均出自標準狀態(25 ℃,100 kPa)下。

參考文獻

  1. ^ 1.0 1.1 1.2 1.3 Kwan-Young Jung; Steven Fletcher. Fine-tuning the chemo- and regioselective alkylation of 1,4-benzodiazepines: further applications of the Mitsunobu reaction. MedChemComm, 2012. doi:10.1039/C2MD20123B.
  2. ^ Romain Siegrist, Davide Pozzi, Gaël Jacob, Caterina Torrisi, Kilian Colas, Bertrand Braibant, Jacques Mawet, Thomas Pfeifer, Ruben de Kanter, Catherine Roch, Melanie Kessler, Richard Moon, Olivier Corminboeuf, Olivier Bezençon. Structure-Activity Relationship, Drug Metabolism and Pharmacokinetics Properties Optimization, and in Vivo Studies of New Brain Penetrant Triple T-Type Calcium Channel Blockers. Journal of Medicinal Chemistry (2016), 59 (23), 10661-10675. doi:10.1021/acs.jmedchem.6b01356.