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1217716-71-6 | Levofloxacin-d8
CAS No: 1217716-71-6 Catalog No: AG0015WZ MDL No:
Product Description
Catalog Number:
AG0015WZ
Chemical Name:
Levofloxacin-d8
CAS Number:
1217716-71-6
Molecular Formula:
C18H12D8FN3O4
Molecular Weight:
369.4168
IUPAC Name:
(2S)-7-fluoro-2-methyl-6-(2,2,3,3,5,5,6,6-octadeuterio-4-methylpiperazin-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylic acid
InChI:
InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1/i3D2,4D2,5D2,6D2
InChI Key:
GSDSWSVVBLHKDQ-FMBBTWBHSA-N
SMILES:
CN1C([2H])([2H])C([2H])([2H])N(C(C1([2H])[2H])([2H])[2H])c1c(F)cc2c3c1OC[C@@H](n3cc(c2=O)C(=O)O)C
Properties
Complexity:
634
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
369.194g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
8
Molecular Weight:
369.422g/mol
Monoisotopic Mass:
369.194g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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