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DC-756

CAT: 0804-HY-106998Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-106998Size:1 Each
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Description
DC-756 is a fluoroquinolone antibiotic. DC-756 possesses potent activity against Gram-positive and Gram-negative pathogens comparable to Trovafloxacin , with MIC, against Ofloxacin (HY-B0125) -resistant strains 16-fold better than Trovafloxacin. DC-756 is well absorbed orally in rats and found to have good photostability. DC-756 can be used to study bacterial resistance[1].
CAS Number
218281-25-5
UNSPSC
12352005
Target
Antibiotic; Bacterial
Related Pathways
Anti-infection
Field of Research
Infection
Smiles
COC1=C2N(C3CC3)C=C(C(C2=CC(F)=C1N4C[C@@H]([C@@H](C4)N)CF)=O)C(O)=O
Molecular Formula
C19H21F2N3O4
Molecular Weight
393.38
References & Citations
[1]Kaneko T, Linde II RG, Su WG. New antibacterials for resistant organisms. Annual reports in medicinal chemistry. 1999 Jan 1;34:169-78.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
Quinolone

Chemical Information

H6RY8HR9LM
CAS Number218281-25-5
PubChem CID9843521
IUPAC Name7-[(3S,4S)-3-amino-4-(fluoromethyl)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-8-methoxy-4-oxoquinoline-3-carboxylic acid
Molecular FormulaC19H21F2N3O4
Molecular Weight393.4
XLogP0
Topological Polar Surface Area96.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity686
SMILES
COC1=C2C(=CC(=C1N3C[C@@H]([C@@H](C3)N)CF)F)C(=O)C(=CN2C4CC4)C(=O)O
InChI
InChI=1S/C19H21F2N3O4/c1-28-18-15-11(17(25)12(19(26)27)7-24(15)10-2-3-10)4-13(21)16(18)23-6-9(5-20)14(22)8-23/h4,7,9-10,14H,2-3,5-6,8,22H2,1H3,(H,26,27)/t9-,14+/m0/s1
InChIKey
XGZPDXTUAWRGLD-LKFCYVNXSA-N
Chemical Structure
2D Structure
2D structure of H6RY8HR9LM
CAS: 218281-25-5
CID: 9843521
Formula: C19H21F2N3O4
MW: 393.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight393.4
XLogP30
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass393.15001248
Monoisotopic Mass393.15001248
Topological Polar Surface Area96.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity686
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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