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Substance Name: 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-7-(3-amino-4-methyl-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-4-oxo-, (3S-cis)-, monomethanesulfonate
RN: 144176-57-8
InChIKey: CBTZIZOGRLKVTG-BTJVGWIPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H23-F-N4-O3.C-H4-O3-S

Molecular Weight

  • 458.5083
 
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Names and Synonyms

  • 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-7-(3-amino-4-methyl-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-4-oxo-, (3S-cis)-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 144176-57-8

System Generated Number

  • 0144176578

Molecular Formulas

Molecular Formula

  • C18-H23-F-N4-O3.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C18-H23-F-N4-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C18H23FN4O3.CH4O3S/c1-9-6-22(8-13(9)20)16-12(19)5-10-14(24)11(17(25)26)7-23(15(10)21-16)18(2,3)4;1-5(2,3)4/h5,7,9,13H,6,8,20H2,1-4H3,(H,25,26);1H3,(H,2,3,4)/t9-,13+;/m0./s1

InChIKey

CBTZIZOGRLKVTG-BTJVGWIPSA-N

Smiles

C[C@H]1CN(C[C@H]1N)c2c(cc3c(=O)c(cn(c3n2)C(C)(C)C)C(=O)O)F.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2500mg/kg (2500mg/kg)   Journal of Medicinal Chemistry. Vol. 35, Pg. 4205, 1992.