Basic information
- CAS
130539-72-9- Standard SMILES
CC1CCc2c(N3C=CC(=O)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23- InChIKey
WKEGKVZMFNTXSG-UHFFFAOYSA-N- Molecular formula
- C19H17FN2O4
- Average molar mass
- 356.3 g/mol
- Monoisotopic mass
- 356.11723519
Names & identifiers
- Preferred name
- Nadifloxacin isomer 2
- IUPAC
- 7-fluoro-12-methyl-4-oxo-8-(4-oxo-2,3-dihydropyridin-1-yl)-1-azatricyclo[7.3.1.05,13]trideca-2,5,7,9(13)-tetraene-3-carboxylic acid
- English name
- 9-fluoro-6,7-dihydro-5-methyl-1-oxo-8-(4-oxo-1,2,3,4-tetrahydro-1-pyridyl)-1H,5H-benzo[i,j]quinolizine-2-carboxylic acid
- Molecular formula
- C19H17FN2O4
- Molecular weight
- 356.35
Names & synonyms
Nadifloxacin isomer 2130539-72-94-Oxo Nadifloxacin9-fluoro-6,7-dihydro-5-methyl-1-oxo-8-(4-oxo-1,2,3,4-tetrahydro-1-pyridyl)-1H,5H-benzo[i,j]quinolizine-2-carboxylic acidKP7DWT3KSXSCHEMBL103359501H,5H-Benzo[ij]quinolizine-2-carboxylic acid, 8-(3,4-dihydro-4-oxo-1(2H)-pyridinyl)-9-fluoro-6,7-dihydro-5-methyl-1-oxo-1H,5H-Benzo[ij]quinolizine-2-carboxylic acid, 8-(3,4-dihydro-4-oxo-1(2H)-pyridinyl)-9-fluoro-6,7-dihydro-5-methyl-1-oxo-, (+/-)-4-Oxo Nadifloxacin; 1H,5H-Benzo[ij]quinolizine-2-carboxylic acid, 8-(3,4-dihydro-4-oxo-1(2H)-pyridinyl)-9-fluoro-6,7-dihydro-5-methyl-1-oxo-, (+/-)-; 8-(3,4-Dihydro-4-oxo-1(2H)-pyridinyl)-9-fluoro-6,7-dihydro-5-methyl-1-oxo-1H,5H-benzo[ij]quinolizine-2-carboxylic acid8-(3,4-Dihydro-4-oxo-1(2H)-pyridinyl)-9-fluoro-6,7-dihydro-5-methyl-1-oxo-1H,5H-benzo[ij]quinolizine-2-carboxylic aciddifloxacinImpurity2Nadifloxacin Impurity 2
Show more names
9-Fluoro-5-methyl-1-oxo-8-(4-oxo-3,4-dihydropyridin-1(2H)-yl)-6,7-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-2-carboxylic acidNadifloxacin isomer 2Q: What is Nadifloxacin isomer 2 Q: What is the CAS Number of Nadifloxacin isomer 2 Q: What is the storage condition of Nadifloxacin isomer 2
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 77.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 718
Physicochemical properties
- Boiling point
- 601.4 · 601.4±55.0 °C(Predicted)
- Density
- 1.49 · 1.49±0.1 g/cm3(Predicted)
- pka
- 5.55 · 5.55±0.40(Predicted)
Chemistry & industry
Applications
Uses4-Oxo Nadifloxacin is an oxidative impurity of Nadifloxacin (N200700) which is a Fluorinated quinolone antibacterial (topical).
Suppliers18 total
济南百隆化学有限公司[email protected] · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
玺标（上海）科技有限公司18512111473 18512111473 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
Standardpharm Co. Ltd.86-714-3992388 · [email protected]
南京新瑞医药科技有限公司19850079587 · [email protected]
Related reactions
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Compound notes
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