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RX-3117

CAT: 0013-GTR19174185-05Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19174185-05Size:10 mg
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Description
RX-3117 is a novel fluorocyclopentenylcytosine analog with demonstrated anticancer activity in vitro against various cancer cell lines, including those resistant to gemcitabine. Research applications include investigating its mechanism and efficacy in preclinical in vivo models for oncology.
CAS Number
865838-26-2
Product Name Alternative
TV1360, TV-1360, TV 1360, RX 3117, RX3117, RX-3117, S phase, DNMT1, apoptosis, antiproliferative, anti-tumour, Analog, fluorocyclopentenylcytosine, Inhibitor, inhibit, NucleosideAntimetabolite, Nucleoside Antimetabolite/Analog, Nucleoside Antimetabolite, orally active
Field of Research
Cell Biology, Molecular Biology
Purity
97.46% (May vary between batches)
Solubility
DMSO:50 mg/mL (194.39 mM)
Smiles
Nc1ccn ([C@H]2[C@H] (O) [C@H] (O) C (CO) =C2F) c (=O) n1
Molecular Formula
C10H12FN3O4
Molecular Weight
257.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Roducitabine

Roducitabine is a triol that is (1S,2R)-4-fluoro-3-(hydroxymethyl)cyclopent-3-ene-1,2-diol which is substituted by a 4-amino-2-oxopyrimidin-1(2H)-yl group at position 5. It is a cytidine analog which exhibits anticancer activity in several cancers, including gemcitabine-resistant tumours. It has a role as an antimetabolite, an antineoplastic agent, a prodrug, a DNA synthesis inhibitor and an apoptosis inducer. It is a primary allylic alcohol, a triol and an organofluorine compound.

CAS Number865838-26-2
PubChem CID11242315
IUPAC Name4-amino-1-[(1S,4R,5S)-2-fluoro-4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]pyrimidin-2-one
Molecular FormulaC10H12FN3O4
Molecular Weight257.22
XLogP-2.6
Topological Polar Surface Area119
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count18
Formal Charge0
Complexity474
SMILES
C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H](C(=C2F)CO)O)O
InChI
InChI=1S/C10H12FN3O4/c11-6-4(3-15)8(16)9(17)7(6)14-2-1-5(12)13-10(14)18/h1-2,7-9,15-17H,3H2,(H2,12,13,18)/t7-,8-,9+/m1/s1
InChIKey
QLLGKCJUPWYJON-HLTSFMKQSA-N
Chemical Structure
2D Structure
2D structure of Roducitabine
CAS: 865838-26-2
CID: 11242315
Formula: C10H12FN3O4
MW: 257.22
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight257.22
XLogP3-2.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass257.08118403
Monoisotopic Mass257.08118403
Topological Polar Surface Area119 Ų
Heavy Atom Count18
Formal Charge0
Complexity474
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
BA2925-2RX-3117
A21259-2RX-3117 2mg
A21259-25RX-3117 25mg
A21259-10RX-3117 10mg
A21259-1RX-3117 1mg
A21259-100RX-3117 100mg
A21259-50RX-3117 50mg
A21259-5RX-3117 5mg
MBS130757-01RX-3117(TV-1360; Fluorocyclopentenylcytosine)
A21259-10mM-DRX-3117 10mM * 1mL in DMSO

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