11-Cyclopropyl-5,11-dihydro-4-(hydroxymethyl)-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one-d2

CAS: 2733558-78-4

Ref. TR-C988367

Product Information

• Name: 11-Cyclopropyl-5,11-dihydro-4-(hydroxymethyl)-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one-d2
• Synonyms: 11-Cyclopropyl-4-(hydroxymethyl)-5H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6(11H)-one-d2
• CAS: 2733558-78-4

Description

Applications 11-Cyclopropyl-5,11-dihydro-4-(hydroxymethyl)-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one-d2 is a labelled analogue of 11-Cyclopropyl-5,11-dihydro-4-(hydroxymethyl)-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one (C988365), which is a metabolite of Nevirapine (N391275), which is a potent (IC50=84nM) and selective non-nucleoside inhibitor of HIV-1 reverse transcriptase. It is also an antiviral.11-Cyclopropyl-5,11-dihydro-4-(hydroxymethyl)-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one-d2 is also an intermediate in synthesizing Nevirapine-d2 (N391276), an isotope labelled Nevirapine (N391275), which acts as a potent (IC50=84nM) and selective non-nucleoside inhibitor of HIV-1 reverse transcriptase. Antiviral.
References Hargrave, K.D., et al.: J. Med. Chem., 34, 2231 (1991); Cheeseman, S.H., et al.: Antimicrob. Agents Chemother., 37, 178 (1993); Guay, L.A., et al.: Lancet, 354, 795 (1999)

• Brand: TRC

Chemical properties

• Molecular weight: 284.31
• Formula: C₁₅H₁₂D₂N₄O₂
• Color/Form: Yellow Solid
• InChI: InChI=1S/C15H14N4O2/c20-8-9-5-7-17-14-12(9)18-15(21)11-2-1-6-16-13(11)19(14)10-3-4-10/h1-2,5-7,10,20H,3-4,8H2,(H,18,21)/i8D2
• InChI key: InChIKey=SEBABOMFNCVZGF-MGVXTIMCSA-N
• SMILES: [2H]C([2H])(O)c1ccnc2c1NC(=O)c1cccnc1N2C1CC1