(2R,3R,4R,5R)-5-(2-Amino-6-chloro-9H-purin-9-yl)-2-[(4-chlorobenzoyloxy)methyl]-4-fluoro-4-methyloxolan-3-yl 4-chlorobenzoate

Name: (2R,3R,4R,5R)-5-(2-Amino-6-chloro-9H-purin-9-yl)-2-[(4-chlorobenzoyloxy)methyl]-4-fluoro-4-methyloxolan-3-yl 4-chlorobenzoate
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CAS No. 1294481-82-5
Cat. No. CS-0053475
Purity≥97%
MDL No.None

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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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(2R,3R,4R,5R)-5-(2-Amino-6-chloro-9H-purin-9-yl)-2-[(4-chlorobenzoyloxy)methyl]-4-fluoro-4-methyloxolan-3-yl 4-chlorobenzoate|CS-0053475

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General Information

CAS No. 1294481-82-5
Cat. No. CS-0053475
Purity ≥97%
MDL No. None
Storage -20°C, sealed storage, away from moisture and light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₅H₁₉Cl₃FN₅O₅
Molecular Weight 594.81
Synonym(s) 9-[(2R)-3,5-bis-O-(4-Chlorobenzoyl)-2-deoxy-2-fluoro-2-Methyl-b-D-erythro-pentofuranosyl]-6-chloro-9H-purin-2-aMine
SMILES ClC1=NC(N)=NC2=C1N=CN2[C@@H]3O[C@H](COC(C4=CC=C(Cl)C=C4)=O)[C@@H](OC(C5=CC=C(Cl)C=C5)=O)[C@@]3(C)F

Description

This nucleoside analog features a fluorinated oxolane ring bearing a chlorobenzoyloxy methyl group and a 2-amino-6-chloro-9H-purin-9-yl moiety, delivering enhanced stability and targeted bioavailability. The 4-chlorobenzoate ester facilitates controlled release in biological systems.

Application

This compound serves as a key nucleoside analog intermediate, enabling efficient synthesis of purine-based building blocks. The protected hydroxyl groups and orthogonal functionalization support reliable glycosylation and derivatization workflows. Bench-stable and amenable to standard purification methods, it facilitates scalable access to antiviral and anticancer scaffolds through established coupling and deprotection protocols.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 131.45
LogP 5.0769
H_Acceptors 10
H_Donors 1
Rotatable_Bonds 6

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(2R,3R,4R,5R)-5-(2-Amino-6-chloro-9H-purin-9-yl)-2-[(4-chlorobenzoyloxy)methyl]-4-fluoro-4-methyloxolan-3-yl 4-chlorobenzoate

CAS No. 1294481-82-5

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