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CAS 864953-29-7

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1-(4-Benzoyl-1-piperazinyl)-2-[4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1-[(phosphonooxy)methyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]-1,2-ethanedione

Description:
1-(4-Benzoyl-1-piperazinyl)-2-[4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1-[(phosphonooxy)methyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]-1,2-ethanedione, with CAS number 864953-29-7, is a complex organic compound characterized by its multi-functional structure. It features a piperazine ring, which is known for its biological activity, and incorporates a benzoyl group that may enhance its lipophilicity. The presence of a methoxy group and a triazole moiety suggests potential pharmacological properties, possibly related to antimicrobial or antifungal activities. Additionally, the phosphonooxy group indicates that this compound may exhibit properties relevant to biochemistry, particularly in relation to enzyme inhibition or as a potential prodrug. The ethanedione component suggests reactivity that could be exploited in further chemical modifications or interactions. Overall, this compound's intricate structure implies a diverse range of potential applications in medicinal chemistry and drug development, although specific biological activities would require empirical investigation.
Formula:C25H26N7O8P
InChI:InChI=1S/C25H26N7O8P/c1-16-27-14-32(28-16)23-21-20(19(39-2)12-26-23)18(13-31(21)15-40-41(36,37)38)22(33)25(35)30-10-8-29(9-11-30)24(34)17-6-4-3-5-7-17/h3-7,12-14H,8-11,15H2,1-2H3,(H2,36,37,38)
InChI key:InChIKey=SWMDAPWAQQTBOG-UHFFFAOYSA-N
SMILES:C(OP(=O)(O)O)N1C=2C(C(C(C(=O)N3CCN(C(=O)C4=CC=CC=C4)CC3)=O)=C1)=C(OC)C=NC2N5N=C(C)N=C5
Synonyms:
  • 1,2-Ethanedione, 1-(4-benzoyl-1-piperazinyl)-2-[4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1-[(phosphonooxy)methyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]-
  • 1-(4-Benzoyl-1-piperazinyl)-2-[4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1-[(phosphonooxy)methyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]-1,2-ethanedione
  • Fostemsavir
  • Piperazine, 1-benzoyl-4-[[4-methoxy-7-(3-methyl-1H-1,2,4-triazol-1-yl)-1-[(phosphonooxy)methyl]-1H-pyrrolo[2,3-c]pyridin-3-yl]oxoacetyl]-
  • Rukobia
  • BMS 663068
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