1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione
TL;DR: 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione (CAS 59837-34-2) is a chemical compound with molecular formula C12H18N2O6S and molecular weight 318.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(1,2-dihydroxyethyl)-3-ethylsulfanyl-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
Also Known As: 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione, 1-[5-(1,2-dihydroxyethyl)-3-ethylsulfanyl-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
| Molecular Formula | C12H18N2O6S |
|---|---|
| Molecular Weight | 318.09 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.08856 |
| Heavy Atoms | 21 |
| Complexity | 445.0 |
Chemical Identifiers
| CAS Number | 59837-34-2 |
|---|---|
| SMILES | CCSC1C(C(OC1N2C=CC(=O)NC2=O)C(CO)O)O |
| InChIKey | ANVDWOFEZYNNDC-UHFFFAOYSA-N |
Product Overview
1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione (CAS 59837-34-2), with molecular formula C12H18N2O6S and molecular weight 318.09 g/mol. IUPAC: 1-[5-(1,2-dihydroxyethyl)-3-ethylsulfanyl-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione.
Chemical Property Profile of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione
Property Insights of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione
The XLogP value of -0.9 indicates that 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione has 4 hydrogen bond donor(s) and 7 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 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione?
The CAS number of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione is 59837-34-2.
What is the molecular formula of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione?
The molecular formula of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione is C12H18N2O6S.
What is the molecular weight of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione?
The molecular weight of 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione is 318.09 g/mol.
Where can I buy 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione?
You can request a quote for 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-S-Ethyl-2-thiohexofuranosyl)pyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.