CAS 308831-61-0

N-[4-[1-[(2,6-Difluorophenyl)methyl]-1,2,3,4-tetrahydro-5-[[methyl(phenylmethyl)amino]methyl]-2,4-dioxo-3-phenylthieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxyurea

Description:

N-[4-[1-[(2,6-Difluorophenyl)methyl]-1,2,3,4-tetrahydro-5-[[methyl(phenylmethyl)amino]methyl]-2,4-dioxo-3-phenylthieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxyurea, with CAS number 308831-61-0, is a complex organic compound characterized by its intricate molecular structure, which includes multiple functional groups such as urea and thieno[2,3-d]pyrimidine moieties. This compound exhibits properties typical of pharmaceuticals, including potential biological activity, which may be attributed to its unique arrangement of aromatic rings and substituents. The presence of difluorophenyl and methoxy groups suggests that it may interact with biological targets through various mechanisms, potentially influencing its solubility and bioavailability. Its synthesis likely involves multi-step organic reactions, reflecting the complexity of its structure. As with many compounds in medicinal chemistry, understanding its pharmacokinetics and pharmacodynamics would be essential for evaluating its therapeutic potential. Safety and handling precautions are necessary due to the potential toxicity associated with complex organic molecules.

Formula: C₃₆H₃₁F₂N₅O₄S

InChI: InChI=1S/C36H31F2N5O4S/c1-41(20-23-10-5-3-6-11-23)21-28-31-33(44)43(26-12-7-4-8-13-26)36(46)42(22-27-29(37)14-9-15-30(27)38)34(31)48-32(28)24-16-18-25(19-17-24)39-35(45)40-47-2/h3-19H,20-22H2,1-2H3,(H2,39,40,45)

InChI key: InChIKey=UCQSBGOFELXYIN-UHFFFAOYSA-N

SMILES: C(N1C2=C(C(CN(CC3=CC=CC=C3)C)=C(S2)C4=CC=C(NC(NOC)=O)C=C4)C(=O)N(C1=O)C5=CC=CC=C5)C6=C(F)C=CC=C6F

Synonyms:

• 1-{4-[5-{[Benzyl(Methyl)Amino]Methyl}-1-(2,6-Difluorobenzyl)-2,4-Dioxo-3-Phenyl-1,2,3,4-Tetrahydrothieno[2,3-D]Pyrimidin-6-Yl]Phenyl}-3-Methoxyurea
• 5-(N-Benzyl-N-methylaminomethyl)-1-(2,6-difluorobenzyl)-6-[4-(3-methoxyureido)phenyl]-3-phenylthieno[2,3-d]pyrimidine-2,4(1H,3H)dione
• N-[4-[1-[(2,6-Difluorophenyl)methyl]-1,2,3,4-tetrahydro-5-[[methyl(phenylmethyl)amino]methyl]-2,4-dioxo-3-phenylthieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxyurea
• Sufugolix
• Tak-013
• Urea, N-[4-[1-[(2,6-difluorophenyl)methyl]-1,2,3,4-tetrahydro-5-[[methyl(phenylmethyl)amino]methyl]-2,4-dioxo-3-phenylthieno[2,3-d]pyrimidin-6-yl]phenyl]-N′-methoxy-

Sufugolix

CAS: 308831-61-0

Sufugolix

Purity: ≥95%

Molecular weight: 667.72g/mol

Ref: 54-BUP01898

Sufugolix

CAS: 308831-61-0

Sufugolix (TAK-013) is a potent and orally available luteinizing hormone-releasing hormone LHRH receptor.

Formula: C₃₆H₃₁F₂N₅O₄S

Purity: 97.78%

Color and Shape: Solid

Molecular weight: 667.72

Ref: TM-T3538