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CAS 737789-87-6

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N-[4-[1-[(2,6-Difluorophenyl)methyl]-5-[(dimethylamino)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxyurea

Description:
N-[4-[1-[(2,6-Difluorophenyl)methyl]-5-[(dimethylamino)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxyurea, with CAS number 737789-87-6, is a complex organic compound characterized by its unique structural features, including multiple functional groups and a fused ring system. This compound exhibits properties typical of urea derivatives, which often include biological activity, making it of interest in pharmaceutical research. The presence of difluorophenyl and methoxy groups suggests potential lipophilicity, which can influence its solubility and permeability in biological systems. The tetrahydro and thieno[2,3-d]pyrimidine moieties contribute to its structural diversity, potentially impacting its interaction with biological targets. Additionally, the dimethylamino group may enhance its pharmacological profile by improving binding affinity or modulating activity. Overall, this compound's intricate structure and functionalization indicate its potential utility in medicinal chemistry, particularly in the development of therapeutic agents.
Formula:C29H27F2N7O5S
InChI:InChI=1S/C29H27F2N7O5S/c1-36(2)14-19-24-26(39)38(22-12-13-23(42-3)34-33-22)29(41)37(15-18-20(30)6-5-7-21(18)31)27(24)44-25(19)16-8-10-17(11-9-16)32-28(40)35-43-4/h5-13H,14-15H2,1-4H3,(H2,32,35,40)
InChI key:InChIKey=AOMXMOCNKJTRQP-UHFFFAOYSA-N
SMILES:C(N1C2=C(C(CN(C)C)=C(S2)C3=CC=C(NC(NOC)=O)C=C3)C(=O)N(C1=O)C4=CC=C(OC)N=N4)C5=C(F)C=CC=C5F
Synonyms:
  • 1-[4-[1-[(2,6-Difluorophenyl)methyl]-5-[(dimethylamino)methyl]-3-(6-methoxypyridazin-3-yl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-3-methoxyurea
  • N-[4-[1-[(2,6-Difluorophenyl)methyl]-5-[(dimethylamino)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxyurea
  • Orgovyx
  • Rvt 601
  • TAK-385,Relugolix
  • Tak-385
  • Urea, N-[4-[1-[(2,6-difluorophenyl)methyl]-5-[(dimethylamino)methyl]-1,2,3,4-tetrahydro-3-(6-methoxy-3-pyridazinyl)-2,4-dioxothieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxy-
  • Relugolix
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