N-(5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide (2Z)-2-butenedioate (1:1) | CAS No. 1802998-75-9

N-(5-{4-[(1,1-Dioxido-4-thiomorpholinyl)methyl]phenyl}[1,2,4]triazolo[1,5-a]pyridin-2-yl)cyclopropanecarboxamide (2Z)-2-butenedioate (1:1)

Basic Information

CAS Number

1802998-75-9

Molecular Formula

C25H27N5O7S

Molecular Weight

541.59 g/mol

AD

Basic Physical Properties

c1cc(n2c(c1)nc(n2)NC(=O)C3CC3)c4ccc(cc4)CN5CCS(=O)(=O)CC5.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C21H23N5O3S.C4H4O4/c27-20(17-8-9-17)23-21-22-19-3-1-2-18(26(19)24-21)16-6-4-15(5-7-16)14-25-10-12-30(28,29)13-11-25;5-3(6)1-2-4(7)8/h1-7,17H,8-14H2,(H,23,24,27);1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

BFENHEAPFWQJFL-BTJKTKAUSA-N

LogP

1.6869999999999998

Topological Polar Surface Area

171.26999999999995 Ų

Hydrogen Bond Donor/Acceptor

3 / 12

Complexity

834

Synonyms & References

English

  • Filgotinib maleate
  • JG8OB4UL9Y
  • Filgotinib maleate [USAN]
  • Filgotinib maleate (JAN/USAN)
  • D11106
  • Cyclopropanecarboxamide, N-(5-(4-((1,1-dioxido-4-thiomorpholinyl)methyl)phenyl)(1,2,4)triazolo(1,5-a)pyridin-2-yl)-, (2Z)-2-butenedioate (1:1)

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