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Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- structure
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Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-

TL;DR: Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- (CAS 127479-69-0) is a chemical compound with molecular formula C13H17N5O5 and molecular weight 323.12296 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1-[(2R,4S,5S)-5-(hydroxymethyl)-4-[4-(hydroxymethyl)triazol-1-yl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione

Also Known As: Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-, 3'-(4-Hydroxymethyl-1,2,3-triazol-1-yl)-3'-deoxythymidine, 3 -(4-(Hydroxymethyl)-1H-1,2,3-triazol-1-yl)-3 -deoxythymidine, 1-((2R,4S,5S)-5-(hydroxymethyl)-4-(4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione, 1-[(2R,4S,5S)-5-(hydroxymethyl)-4-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]oxolan-2-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione

CAS Number
127479-69-0
Molecular Formula
C13H17N5O5
Molecular Weight
323.12296 g/mol
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Technical Specifications

Molecular FormulaC13H17N5O5
Molecular Weight323.12296 g/mol
XLogP-2.3
Topological Polar Surface Area (TPSA)130.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors7
Rotatable Bonds4
Exact Mass323.12296 Da
Heavy Atoms23
Complexity527.0
SMILESCC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N3C=C(N=N3)CO
InChIKeyNBDUKFFZXZQJHT-HBNTYKKESA-N

Chemical Property Profile of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-

XLogP
-2.3
TPSA (Topological Polar Surface Area)
130.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
7
Rotatable Bonds
4
Heavy Atoms
23
Complexity
527.0
Exact Mass
323.12296
Monoisotopic Mass
323.12296
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-

The XLogP value of -2.3 indicates that Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-. Following Lipinski's Rule of Five, Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-?

The CAS number of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- is 127479-69-0.

What is the molecular formula of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-?

The molecular formula of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- is C13H17N5O5.

What is the molecular weight of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-?

The molecular weight of Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- is 323.12296 g/mol.

Where can I buy Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-?

You can request a quote for Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]-?

Yes, CoreyChem provides custom synthesis services for Thymidine, 3'-deoxy-3'-[4-(hydroxymethyl)-1H-1,2,3-triazol-1-yl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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