(6R,7R)-7-{[(3,5-Dichloro-4-oxo-1(4H)-pyridinyl)acetyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid | CAS No. 70149-63-2

(6R,7R)-7-{[(3,5-Dichloro-4-oxo-1(4H)-pyridinyl)acetyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Basic Information

CAS Number

70149-63-2

Molecular Formula

C15H13Cl2N3O5S

Molecular Weight

418.26 g/mol

AD

Basic Physical Properties

CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)Cn3cc(c(=O)c(c3)Cl)Cl)SC1)C(=O)O

InChI

InChI=1S/C15H13Cl2N3O5S/c1-6-5-26-14-10(13(23)20(14)11(6)15(24)25)18-9(21)4-19-2-7(16)12(22)8(17)3-19/h2-3,10,14H,4-5H2,1H3,(H,18,21)(H,24,25)/t10-,14-/m1/s1

InChIKey

HIOXARKGMQFYCS-QMTHXVAHSA-N

LogP

0.9136000000000002

Topological Polar Surface Area

108.71 Ų

Hydrogen Bond Donor/Acceptor

2 / 8

Synonyms & References

English

  • Cefazedone Related Impurity 4
  • Cefazedone Impurity 2
  • Cefazedone Impurity 3
  • Cefazedone Impurity 7
  • (6R,7R)-7-(2-(3,5-dichloro-4-oxopyridin-1(4H)-yl)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

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