3'-N-Cyanoguanidino-3'-deoxythymidine
TL;DR: 3'-N-Cyanoguanidino-3'-deoxythymidine (CAS 142543-83-7) is a chemical compound with molecular formula C12H16N6O4 and molecular weight 308.1233 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-cyano-2-[(2S,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]guanidine
Also Known As: 3'N-CNGuanidino-dT, 3'-N-Cyanoguanidino-3'-deoxythymidine, 3 -(2-Cyanoguanidino)-3 -deoxythymidine, 1-cyano-2-[(2S,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl]guanidine, 2-cyano-1-[(2S,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-3-yl]guanidine
Technical Specifications
| Molecular Formula | C12H16N6O4 |
| Molecular Weight | 308.1233 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 153.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 308.1233 Da |
| Heavy Atoms | 22 |
| Complexity | 592.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N=C(N)NC#N |
| InChIKey | CFOAZGXWSMISJZ-DJLDLDEBSA-N |
Chemical Property Profile of 3'-N-Cyanoguanidino-3'-deoxythymidine
Property Insights of 3'-N-Cyanoguanidino-3'-deoxythymidine
The XLogP value of -1.9 indicates that 3'-N-Cyanoguanidino-3'-deoxythymidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 153.0 Ų indicates high polarity, suggesting 3'-N-Cyanoguanidino-3'-deoxythymidine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-N-Cyanoguanidino-3'-deoxythymidine has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3'-N-Cyanoguanidino-3'-deoxythymidine?
The CAS number of 3'-N-Cyanoguanidino-3'-deoxythymidine is 142543-83-7.
What is the molecular formula of 3'-N-Cyanoguanidino-3'-deoxythymidine?
The molecular formula of 3'-N-Cyanoguanidino-3'-deoxythymidine is C12H16N6O4.
What is the molecular weight of 3'-N-Cyanoguanidino-3'-deoxythymidine?
The molecular weight of 3'-N-Cyanoguanidino-3'-deoxythymidine is 308.1233 g/mol.
Where can I buy 3'-N-Cyanoguanidino-3'-deoxythymidine?
You can request a quote for 3'-N-Cyanoguanidino-3'-deoxythymidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-N-Cyanoguanidino-3'-deoxythymidine?
Yes, CoreyChem provides custom synthesis services for 3'-N-Cyanoguanidino-3'-deoxythymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.