Thymidine, 3'-(carboxymethyl)-3'-deoxy-
TL;DR: Thymidine, 3'-(carboxymethyl)-3'-deoxy- (CAS 195519-89-2) is a chemical compound with molecular formula C12H16N2O6 and molecular weight 284.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2S,3R,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]acetic acid
Also Known As: 3'-CH2COOH-ddT, 3'-Carboxymethyl-3'-deoxythymidine, Thymidine, 3'-(carboxymethyl)-3'-deoxy-, 2-(3'-deoxythymidin-3'-yl)acetic acid, 3'-(Carboxymethyl)-3'-deoxythymidine
| Molecular Formula | C12H16N2O6 |
|---|---|
| Molecular Weight | 284.10 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.10083 |
| Heavy Atoms | 20 |
| Complexity | 475.0 |
Chemical Identifiers
| CAS Number | 195519-89-2 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)CC(=O)O |
| InChIKey | JLJJOONIKQRRIX-IWSPIJDZSA-N |
Product Overview
Thymidine, 3'-(carboxymethyl)-3'-deoxy- (CAS 195519-89-2), with molecular formula C12H16N2O6 and molecular weight 284.10 g/mol. IUPAC: 2-[(2S,3R,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]acetic acid.
Chemical Property Profile of Thymidine, 3'-(carboxymethyl)-3'-deoxy-
Property Insights of Thymidine, 3'-(carboxymethyl)-3'-deoxy-
The XLogP value of -2.3 indicates that Thymidine, 3'-(carboxymethyl)-3'-deoxy- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Thymidine, 3'-(carboxymethyl)-3'-deoxy-. Following Lipinski's Rule of Five, Thymidine, 3'-(carboxymethyl)-3'-deoxy- has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Thymidine, 3'-(carboxymethyl)-3'-deoxy-?
The CAS number of Thymidine, 3'-(carboxymethyl)-3'-deoxy- is 195519-89-2.
What is the molecular formula of Thymidine, 3'-(carboxymethyl)-3'-deoxy-?
The molecular formula of Thymidine, 3'-(carboxymethyl)-3'-deoxy- is C12H16N2O6.
What is the molecular weight of Thymidine, 3'-(carboxymethyl)-3'-deoxy-?
The molecular weight of Thymidine, 3'-(carboxymethyl)-3'-deoxy- is 284.10 g/mol.
Where can I buy Thymidine, 3'-(carboxymethyl)-3'-deoxy-?
You can request a quote for Thymidine, 3'-(carboxymethyl)-3'-deoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thymidine, 3'-(carboxymethyl)-3'-deoxy-?
Yes, KEHONG BIO provides custom synthesis services for Thymidine, 3'-(carboxymethyl)-3'-deoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.