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Fludarabine

CAT: 1596-AR-F01629-02Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-F01629-02Size:50 Units
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CAS Number
21679-14-1
Synonyms
(2R,3S,4S,5R) -2- (6-amino-2-fluoro-9H-purin-9-yl) -5- (hydroxymethyl) tetrahydrofuran-3,4-diol;9-β-D-Arabinofuranosyl-2-fluoro-9H-purin-6-amine; 2-Fluoro-9-?-D-arabinofuranosyladenine; 2-Fluoroadenine Arabinoside; NSC 118218; NSC 118218H
Molecular Formula
C10H12FN5O4
Molecular Weight
285.24
API Name
Fludarabine

Chemical Information

Fludarabine

(2R,3S,4S,5R)-2-(6-amino-2-fluoro-9-purinyl)-5-(hydroxymethyl)oxolane-3,4-diol is a purine nucleoside.

CAS Number21679-14-1
PubChem CID657237
IUPAC Name(2R,3S,4S,5R)-2-(6-amino-2-fluoropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Molecular FormulaC10H12FN5O4
Molecular Weight285.23
XLogP-0.6
Topological Polar Surface Area140
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity367
SMILES
C1=NC2=C(N=C(N=C2N1[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)F)N
InChI
InChI=1S/C10H12FN5O4/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,14,15)/t3-,5-,6+,9-/m1/s1
InChIKey
HBUBKKRHXORPQB-FJFJXFQQSA-N
Chemical Structure
2D Structure
2D structure of Fludarabine
CAS: 21679-14-1
CID: 657237
Formula: C10H12FN5O4
MW: 285.23
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight285.23
XLogP3-0.6
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Exact Mass285.08733204
Monoisotopic Mass285.08733204
Topological Polar Surface Area140 Ų
Heavy Atom Count20
Formal Charge0
Complexity367
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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