Gatifloxacin

Molecular Mass: 375.4 g/mol

Formula: C₁₉H₂₂FN₃O₄

Smiles: COc1c(N2CCNC(C)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12

Synonymes:

Gatifloxacin, 112811-59-3, Tequin, Gatiflo, Zymar, AM-1155, Gatifloxacine, Zymaxid, Zymer, gatifloxacin anhydrous, AM 1155, 3-Quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-, gatifloxacino, 1-Cyclopropyl-1,4-dihydro-6-fluoro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid, gatifloxacinum, DTXSID5045704, PD-135432, NSC-758701, CHEBI:5280, BMS-206584-01, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid, 81485Y3A9A, Gatifloxacin (sesquihydrate), (+-)-1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid, DTXCID3025704, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid, BMS-20658401, BMS206584, BMS 206584, RefChem:142731, J01MA16, S01AE06, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-4-ium-1-yl)-4-oxoquinoline-3-carboxylate, L4618BD7KJ, 1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, CG 5501, BMS-206584, GTFX, MFCD00895399, 160738-57-8, Gatifloxacin (INN), CHEMBL31, gatifloxin, Gatilox, Gatiquin, Gatispan, Gaity, 1-Cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, NCGC00068236-02, Tymer, GATIFLOXACIN [INN], 1-Cyclopropyl-6-fluoro-8-methoxy-1,4-dihydro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylicacid, Gatifloxacin [USAN:INN], Bonoq, BMS 206584-01, PD 135432, (+/-)-1-cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro- 8-methoxy-7-(3-methylpiperazin-1-yl)- 4-oxo-quinoline-3-carboxylic acid, SMR000043336, CAS-112811-59-3, Zymer (TN), SR-01000610458, CG-5501, Gatifloxcin, Tequin in dextrose 5% in plastic container, AM-1155 (*Sesquihydrate*), Gatifloxacin & Gamma Interferon, UNII-81485Y3A9A, Kinome_3137, Spectrum_001909, CPD000043336, Gatifloxacin (Standard), Spectrum2_000487, Spectrum3_000999, Spectrum4_001127, Spectrum5_001468, GATIFLOXACIN [MI], Epitope ID:540297, SCHEMBL22591, BSPBio_002697, KBioGR_001613, KBioSS_002448, MLS000040259, MLS000759493, MLS006011836, GATIFLOXACIN [WHO-DD], SPECTRUM1504272, SPBio_000353, orb1309089, orb3025506, SCHEMBL29356306, Gatifloxacin - Bio-X trade mark, GTPL10816, KBio2_002442, KBio2_005010, KBio2_007578, KBio3_001917, MSK5720, GLXC-22553, HMS1922J15, HMS2090K10, HMS2093G06, HMS2233D20, HMS3259P06, HMS3372J10, HMS3372J12, HMS3715N03, HMS5079D13, Pharmakon1600-01504272, ALBB-028535, RKL10068, Tox21_110984, AM1155, BBL010485, BDBM50117914, CCG-39529, CG5501, EBC-11236, HB3263, HY-10581R, MSK5720-100M, NSC758701, s1340, STK801620, AKOS004119932, AKOS016340697, Tox21_110984_1, AC-1944, AC23649, CS-1841, DB01044, KS-1066, NC00702, NSC 758701, NCGC00068236-03, NCGC00068236-04, NCGC00068236-05, NCGC00068236-06, NCGC00068236-07, NCGC00068236-08, NCGC00095126-01, NCGC00095126-02, NCGC00178525-01, BG300001, HY-10581, SY070194, SBI-0206764.P001, DB-019145, Gatifloxacin 100 microg/mL in Acetonitrile, G0325, Gatifloxacin Solution in Methanol, 100ug/mL, NS00004983, C07661, D08011, AB00171654-13, AB00171654-14, AB00171654_16, AB00171654_17, EN300-19768783, Q2365016, SR-01000610458-2, SR-01000610458-3, BRD-A74980173-001-02-8, BRD-A74980173-001-06-9, BRD-A74980173-001-11-9, BRD-A74980173-213-01-1, Z1824566854, ( inverted exclamation markA)-1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid sesquihydrate, 1-Cyclopropyl-6-fluoro-1,4-dihydro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-3-quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylicacid, 1-cyclopropyl-6-fluoro-8-methoxy-7-(3-methylpiperazino)-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid, 1-cyclopropyl-7-(3-methyl-1-piperazinyl)-6-fluoro-8-methoxy-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

Bioactivity: -

Solubility in Different Solvents

Solvent	Temperature [K]	Crystal form	Solubility [mg/mL]	Reference
1,4-Dioxane	288.15	-	4.223	[379]
1,4-Dioxane	293.15	-	4.902	[379]
1,4-Dioxane	298.15	-	5.648	[379]
1,4-Dioxane	303.15	-	6.51	[379]
1,4-Dioxane	308.15	-	7.453	[379]
1,4-Dioxane	313.15	-	8.56	[379]
1,4-Dioxane	318.15	-	9.802	[379]
1-Butanol	273.15	-	4.408	[379]
1-Butanol	278.15	-	5.063	[379]
1-Butanol	283.15	-	5.944	[379]
1-Butanol	288.15	-	6.958	[379]
1-Butanol	293.15	-	8.003	[379]
1-Butanol	298.15	-	9.187	[379]
1-Butanol	303.15	-	10.61	[379]
1-Butanol	308.15	-	12.12	[379]
1-Butanol	313.15	-	13.89	[379]
1-Butanol	318.15	-	15.89	[379]
1-Propanol	273.15	-	1.865	[379]
1-Propanol	278.15	-	2.269	[379]
1-Propanol	283.15	-	2.766	[379]
1-Propanol	288.15	-	3.306	[379]
1-Propanol	293.15	-	3.908	[379]
1-Propanol	298.15	-	4.609	[379]
1-Propanol	303.15	-	5.404	[379]
1-Propanol	308.15	-	6.302	[379]
1-Propanol	313.15	-	7.325	[379]
1-Propanol	318.15	-	8.489	[379]
Acetone	273.15	-	4.26	[379]
Acetone	278.15	-	4.921	[379]
Acetone	283.15	-	5.776	[379]
Acetone	288.15	-	6.711	[379]
Acetone	293.15	-	7.79	[379]
Acetone	298.15	-	8.974	[379]
Acetone	303.15	-	10.27	[379]
Acetone	308.15	-	11.76	[379]
Acetone	313.15	-	13.41	[379]
Acetone	318.15	-	15.27	[379]
Acetonitrile	273.15	-	9.589	[379]
Acetonitrile	278.15	-	10.96	[379]
Acetonitrile	283.15	-	12.85	[379]
Acetonitrile	288.15	-	15.02	[379]
Acetonitrile	293.15	-	17.46	[379]
Acetonitrile	298.15	-	20.02	[379]
Acetonitrile	303.15	-	22.8	[379]
Acetonitrile	308.15	-	25.98	[379]
Acetonitrile	313.15	-	29.62	[379]
Acetonitrile	318.15	-	33.67	[379]
Dimethylformamide	273.15	-	12.89	[379]
Dimethylformamide	278.15	-	15.14	[379]
Dimethylformamide	283.15	-	17.72	[379]
Dimethylformamide	288.15	-	20.53	[379]
Dimethylformamide	293.15	-	23.82	[379]
Dimethylformamide	298.15	-	27.6	[379]
Dimethylformamide	303.15	-	31.67	[379]
Dimethylformamide	308.15	-	36.33	[379]
Dimethylformamide	313.15	-	41.59	[379]
Dimethylformamide	318.15	-	47.44	[379]
Ethanol	273.15	-	1.717	[379]
Ethanol	278.15	-	2.133	[379]
Ethanol	283.15	-	2.62	[379]
Ethanol	288.15	-	3.163	[379]
Ethanol	293.15	-	3.766	[379]
Ethanol	298.15	-	4.47	[379]
Ethanol	303.15	-	5.28	[379]
Ethanol	308.15	-	6.232	[379]
Ethanol	313.15	-	7.295	[379]
Ethanol	318.15	-	8.531	[379]
Ethyl acetate	273.15	-	12.76	[379]
Ethyl acetate	278.15	-	14.85	[379]
Ethyl acetate	283.15	-	17.17	[379]
Ethyl acetate	288.15	-	19.77	[379]
Ethyl acetate	293.15	-	22.7	[379]
Ethyl acetate	298.15	-	26.05	[379]
Ethyl acetate	303.15	-	29.68	[379]
Ethyl acetate	308.15	-	33.88	[379]
Ethyl acetate	313.15	-	38.5	[379]
Ethyl acetate	318.15	-	43.67	[379]
Isopropanol	273.15	-	0.6171	[379]
Isopropanol	278.15	-	0.7884	[379]
Isopropanol	283.15	-	1.012	[379]
Isopropanol	288.15	-	1.254	[379]
Isopropanol	293.15	-	1.581	[379]
Isopropanol	298.15	-	1.957	[379]
Isopropanol	303.15	-	2.418	[379]
Isopropanol	308.15	-	2.961	[379]
Isopropanol	313.15	-	3.606	[379]
Isopropanol	318.15	-	4.355	[379]
Methanol	273.15	-	1.8	[379]
Methanol	278.15	-	2.189	[379]
Methanol	283.15	-	2.758	[379]
Methanol	288.15	-	3.36	[379]
Methanol	293.15	-	4.061	[379]
Methanol	298.15	-	4.894	[379]
Methanol	303.15	-	5.837	[379]
Methanol	308.15	-	6.85	[379]
Methanol	313.15	-	8.167	[379]
Methanol	318.15	-	9.639	[379]
Methyl ethyl ketone	273.15	-	6.788	[379]
Methyl ethyl ketone	278.15	-	7.974	[379]
Methyl ethyl ketone	283.15	-	9.301	[379]
Methyl ethyl ketone	288.15	-	10.86	[379]
Methyl ethyl ketone	293.15	-	12.62	[379]
Methyl ethyl ketone	298.15	-	14.57	[379]
Methyl ethyl ketone	303.15	-	16.81	[379]
Methyl ethyl ketone	308.15	-	19.31	[379]
Methyl ethyl ketone	313.15	-	22.12	[379]
Methyl ethyl ketone	318.15	-	25.28	[379]
Toluene	273.15	-	0.213	[379]
Toluene	278.15	-	0.291	[379]
Toluene	283.15	-	0.3891	[379]
Toluene	288.15	-	0.5185	[379]
Toluene	293.15	-	0.703	[379]
Toluene	298.15	-	0.9171	[379]
Toluene	303.15	-	1.202	[379]
Toluene	308.15	-	1.55	[379]
Toluene	313.15	-	1.995	[379]
Toluene	318.15	-	2.552	[379]

Molecule 3D descriptors

Descriptor	Value
PMI1	1435.0501
PMI2	4618.2338
PMI3	5682.9318
NPR1	0.2525
NPR2	0.8126
RadiusOfGyration	3.9537
InertialShapeFactor	0.0006
Eccentricity	0.9676
Asphericity	0.4256
SpherocityIndex	0.1618
PBF	0.7957