Sparfloxacin Impurity 11

CAT: 1596-AR-S10696-01Size: 10 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-S10696-01Size:10 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

2935602-86-9

Molecular Formula

C17H13FN2O3S

Molecular Weight

344.36

API Name

Sparfloxacin

Chemical Information

Garenoxacin Impurity 6

CAS Number	2935602-86-9
PubChem CID	176474547
IUPAC Name	8-amino-1-cyclopropyl-6-fluoro-4-oxo-7-thiophen-2-ylquinoline-3-carboxylic acid
Molecular Formula	C17H13FN2O3S
Molecular Weight	344.4
XLogP	3.3
Topological Polar Surface Area	112
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Heavy Atom Count	24
Formal Charge	0
Complexity	594

SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C(=C32)N)C4=CC=CS4)F)C(=O)O

InChI

InChI=1S/C17H13FN2O3S/c18-11-6-9-15(14(19)13(11)12-2-1-5-24-12)20(8-3-4-8)7-10(16(9)21)17(22)23/h1-2,5-8H,3-4,19H2,(H,22,23)

InChIKey

DJIUJUWCUXNGDH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2935602-86-9

CID: 176474547

Formula: C17H13FN2O3S

MW: 344.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	344.4
XLogP3	3.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	344.06309162
Monoisotopic Mass	344.06309162
Topological Polar Surface Area	112 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	594
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
B2030-5000	Sparfloxacin