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 1. Introduction of Moxifloxacin

The Moxifloxacin, with the CAS registry number 151096-09-2, is also known as (1'S,6'S)-1-Cyclopropyl-7-(2,8-diazabicyclo[4.3.0]non-8-yl)-6-fluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid. It belongs to the product category of API. Its EINECS number is 240-540-6. This chemical's molecular formula is C21H24FN3O4 and molecular weight is 401.43. What's more, its systematic name is 1-Cyclopropyl-6-fluoro-8-methoxy-7-[(4aS,7aS)-octahydro-
6H-pyrrolo[3,4-b]pyridin-6-yl]-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid. Its classification code is Anti-Infective Agents. This chemical is used to treat a number of infections including: respiratory tract infections, cellulitis, anthrax, intraabdominal infections, endocarditis, meningitis, and tuberculosis.

2.Physical properties of Moxifloxacin

(1)ACD/LogP: 2.825; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.12; (4)ACD/LogD (pH 7.4): 0.31; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 2.51; (9)#H bond acceptors: 7; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 82.11 ?2; (13)Index of Refraction: 1.633; (14)Molar Refractivity: 101.823 cm3; (15)Molar Volume: 284.995 cm3; (16)Polarizability: 40.366 10-24cm3; (17)Surface Tension: 60.57 dyne/cm; (18)Density: 1.409 g/cm3; (19)Flash Point: 338.672 °C; (20)Enthalpy of Vaporization: 98.821 kJ/mol; (21)Boiling Point: 636.382 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

3.Structure desriptors of Moxifloxacin

(1)SMILES: COc1c2c(cc(c1N3C[C@@H]4CCCN[C@@H]4C3)F)c(=O)c(cn2C5CC5)C(=O)O
(2)Std. InChI: InChI=1S/C21H24FN3O4/c1-29-20-17-13(19(26)14(21(27)28)9-25(17)12-4-5-12)7-15(22)18(20)24-8-11-3-2-6-23-16(11)10-24/h7,9,11-12,16,23H,2-6,8,10H2,1H3,(H,27,28)/t11-,16+/m0/s1
(3)Std. InChIKey: FABPRXSRWADJSP-MEDUHNTESA-N

4.Pharmacodynamics of Moxifloxacin

Moxifloxacin is available as the monohydrochloride salt of 13 1-cyclopropyl-7-[(S,S)-2,8-diazabicyclo[4.3.0]non-8-yl]-6-fluoro-8-methoxy-1,4-dihydro-4-oxo-3 14 quinoline carboxylic acid. It is a slightly yellow to yellow crystalline substance with a molecular 15 weight of 437.9. Its empirical formula is C21H24FN3O4*HCl." Quoting from the 29 December 2008 package insert for Avelox. There are a number of endogenous compounds that have been reported to be affected by moxifloxacin as inhibitors, alteraters, and depletors. See the latest package insert for Ciprofloxacin for additional details.

5.Mechanism of action of Moxifloxacin

Moxifloxacin is a broad-spectrum antibiotic that is active against both Gram-positive and Gram-negative bacteria. It functions by inhibiting DNA gyrase, a type II topoisomerase, and topoisomerase IV, enzymes necessary to separate bacterial DNA, thereby inhibiting cell replication. This mechanism can also affect mammalian cell replication. In particular, some congeners of this drug family (for example those that contain the C-8 fluorine), display high activity not only against bacterial topoisomerases, but also against eukaryotic topoisomerases and are toxic to cultured mammalian cells and in vivo tumor models. Although quinolones are highly toxic to mammalian cells in culture, its mechanism of cytotoxic action is not known. Quinolone-induced DNA damage was first reported in 1986 (Hussy et al.).

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