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

Base Information
  • Chemical Name:1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-7-(3-amino-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-4-oxo-, (S)-, monomethanesulfonate
  • CAS No.:144043-36-7
  • Molecular Formula:C18H25FN4O6S
  • Molecular Weight:444.4777
  • Hs Code.:
  • DSSTox Substance ID:DTXSID30162605
  • Mol file:144043-36-7.mol
1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-7-(3-amino-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-4-oxo-, (S)-, monomethanesulfonate

Synonyms:1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-7-(3-amino-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-4-oxo-, (S)-, monomethanesulfonate;144043-36-7;1,8-Naphthyridine-3-carboxylic acid, 7-(3-amino-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-1,4-dihydro-4-oxo-, (S)-, monomethanesulfonate;C17-H21-F-N4-O3.C-H4-O3-S;DTXSID30162605;LS-95924

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Chemical Property of 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-7-(3-amino-1-pyrrolidinyl)-1-(1,1-dimethylethyl)-6-fluoro-4-oxo-, (S)-, monomethanesulfonate
Chemical Property:
  • Vapor Pressure:3.34E-13mmHg at 25°C 
  • Boiling Point:556.1°Cat760mmHg 
  • Flash Point:290.1°C 
  • Density:g/cm3 
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:11
  • Rotatable Bond Count:3
  • Exact Mass:444.14788387
  • Heavy Atom Count:30
  • Complexity:696
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MSDS Files:
Useful:
  • Canonical SMILES:CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CCC(C3)N)F)C(=O)O.CS(=O)(=O)O
  • Isomeric SMILES:CC(C)(C)N1C=C(C(=O)C2=CC(=C(N=C21)N3CC[C@@H](C3)N)F)C(=O)O.CS(=O)(=O)O
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