CAS RN 163253-35-8

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Sitafloxacina sesquihidrato, Thermo Scientific Chemicals

CAS: 163253-35-8 Fórmula molecular: C38H42Cl2F4N6O9 Peso molecular (g/mol): 873.68 Clave InChI: MPORYQCGWFQFLA-UHFFFAOYNA-N Nombre IUPAC: ácido bis(7-{7-amino-5-azaspiro[2.4]heptan-5-il}-8-cloro-6-fluoro-1-(2-fluorociclopropil)-4-oxo-1,4-dihidroquinolina-3-carboxílico) trihidrato SMILES: O.O.O.NC1CN(CC11CC1)C1=C(F)C=C2C(=O)C(=CN(C3CC3F)C2=C1Cl)C(O)=O.NC1CN(CC11CC1)C1=C(F)C=C2C(=O)C(=CN(C3CC3F)C2=C1Cl)C(O)=O

Precio y disponibilidad
Especificaciones

Clave InChI	MPORYQCGWFQFLA-UHFFFAOYNA-N
Fórmula molecular	C38H42Cl2F4N6O9
CAS	163253-35-8
Peso molecular (g/mol)	873.68
SMILES	O.O.O.NC1CN(CC11CC1)C1=C(F)C=C2C(=O)C(=CN(C3CC3F)C2=C1Cl)C(O)=O.NC1CN(CC11CC1)C1=C(F)C=C2C(=O)C(=CN(C3CC3F)C2=C1Cl)C(O)=O
Nombre IUPAC	ácido bis(7-{7-amino-5-azaspiro[2.4]heptan-5-il}-8-cloro-6-fluoro-1-(2-fluorociclopropil)-4-oxo-1,4-dihidroquinolina-3-carboxílico) trihidrato

Sitafloxacina Sesquihidrato, TRC

CAS: 163253-35-8 Fórmula molecular: 2 C19 H18 Cl F2 N3 O3 . 3 H2 O Peso molecular (g/mol): 873.67 Sinónimo: 3-Quinolinecarboxylic acid, 7-[(7S)-7-amino-5-azaspiro[2.4]hept-5-yl]-8-chloro-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-1,4-dihydro-4-oxo-, hydrate (2:3),3-Quinolinecarboxylic acid, 7-(7-amino-5-azaspiro[2.4]hept-5-yl)-8-chloro-6-fluoro-1-(2-fluorocyclopropyl)-1,4-dihydro-4-oxo-, hydrate (2:3), [1R-[1α(S*),2α]]-,Sitafloxacin sesquihydrate Nombre IUPAC: 7-[(7S)-7-amino-5-azaspiro[2.4]heptano-5-il]-8-cloro-6-fluoro-1-[(1R,2S)-2-fluorociclopropilo]-4-oxoquinolina-3-carboxílico; trihidrato SMILES: O.O.O.N[C@@H]1CN(CC12CC2)c3c(F)cc4C(=O)C(=CN([C@@H]5C[C@@H]5F)c4c3Cl)C(=O)O.N[C@@H]6CN(CC67CC7)c8c(F)cc9C(=O)C(=CN([C@@H]%10C[C@@H]%10F)c9c8Cl)C(=O)O

Precio y disponibilidad
Especificaciones

Sinónimo	3-Quinolinecarboxylic acid, 7-[(7S)-7-amino-5-azaspiro[2.4]hept-5-yl]-8-chloro-6-fluoro-1-[(1R,2S)-2-fluorocyclopropyl]-1,4-dihydro-4-oxo-, hydrate (2:3),3-Quinolinecarboxylic acid, 7-(7-amino-5-azaspiro[2.4]hept-5-yl)-8-chloro-6-fluoro-1-(2-fluorocyclopropyl)-1,4-dihydro-4-oxo-, hydrate (2:3), [1R-[1α(S*),2α]]-,Sitafloxacin sesquihydrate
Fórmula molecular	2 C19 H18 Cl F2 N3 O3 . 3 H2 O
CAS	163253-35-8
Peso molecular (g/mol)	873.67
SMILES	O.O.O.N[C@@H]1CN(CC12CC2)c3c(F)cc4C(=O)C(=CN([C@@H]5C[C@@H]5F)c4c3Cl)C(=O)O.N[C@@H]6CN(CC67CC7)c8c(F)cc9C(=O)C(=CN([C@@H]%10C[C@@H]%10F)c9c8Cl)C(=O)O
Nombre IUPAC	7-[(7S)-7-amino-5-azaspiro[2.4]heptano-5-il]-8-cloro-6-fluoro-1-[(1R,2S)-2-fluorociclopropilo]-4-oxoquinolina-3-carboxílico; trihidrato

Sitafloxacin hydrate, MedChemExpress

MedChemExpress Sitafloxacin (DU6859a) hydrate is a potent, orally active fluoroquinolone antibiotic with in vitro activity against a broad range of gram-positive and gram-negative bacteria, including anaerobic bacteria, as well as against atypical pathogens. Sitafloxacin can be used for the research of respiratory tract infection and urinary tract infection.

Precio y disponibilidad
Especificaciones

Sinónimo	DU6859a hydrate
Información de solubilidad	DMSO : 8.9 mg/mL (20.37 mM; Need ultrasonic and warming) ∣H2O : 1 mg/mL (2.29 mM; ultrasonic and warming and heat to 80°C)
Forma física	Solid
Almacenamiento recomendado	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Peligro para la salud 1	H302∣H315∣H319∣H335
Color	Blanco
SMILES	N[C@H]1C2(CC2)CN(C(C(Cl)=C3N([C@H]4[C@@H](F)C4)C=C(C(O)=O)C5=O)=C(C=C35)F)C1.[1.5 H2O]
Notas de grado de pureza	Research
Duración de almacenamiento	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Formula Weight (peso de la fórmula)	436.84
Fórmula molecular	C₁₉H₁₈ClF₂N₃O₃.₃/₂H₂O
CAS	163253-35-8
Nombre del producto químico o material	Sitafloxacin hydrate
Porcentaje de pureza	98.0%
Peso molecular (g/mol)	436.84
Grado	Research
Para utilizar con (aplicación)	COVID-19-immunoregulation

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