Besifloxacin-d4 Hydrochloride

Analyte Name

(S)-Besifloxacin (azepine-5,5,6,6-d4) Hydrochloride

Molecular Formula

C19 H17 D4 Cl F N3 O3 . HCl

Molecular Weight

434.32533

Accurate Mass

433.1273

SMILES

[2H]C1([2H])C[C@H](N)CN(C2=C(F)C=C3C(N(C=C(C3=O)C(O)=O)C4CC4)=C2Cl)CC1([2H])[2H].Cl

InChI

InChI=1S/C19H21ClFN3O3.ClH/c20-15-16-12(18(25)13(19(26)27)9-24(16)11-4-5-11)7-14(21)17(15)23-6-2-1-3-10(22)8-23;/h7,9-11H,1-6,8,22H2,(H,26,27);1H/t10-;/m0./s1/i1D2,2D2;

IUPAC

7-[(6~{S})-6-amino-3,3,4,4-tetradeuterio-azepan-1-yl]-8-chloro-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid;hydrochloride

Alternate CAS Number

141388-77-4

Unlabelled CAS Number

Free base: 1398566-42-1

SIL Type

Deuterium

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API; Stable Isotope Labelled

Product Format

Neat

API Family

Besifloxacin Hydrochloride

Purity

>95% (HPLC)