1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine
TL;DR: 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine (CAS 123027-56-5) is a chemical compound with molecular formula C14H16N2O4S and molecular weight 308.08307 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxyethoxymethyl)-5-methyl-6-phenylsulfanylpyrimidine-2,4-dione
Also Known As: HEPT, 6-Hept, HMPTT, 1rti, 1-(2-HYDROXYETHYLOXYMETHYL)-6-PHENYL THIOTHYMINE
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H16N2O4S |
| Molecular Weight | 308.08307 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 308.08307 Da |
| Heavy Atoms | 21 |
| Complexity | 433.0 |
| SMILES | CC1=C(N(C(=O)NC1=O)COCCO)SC2=CC=CC=C2 |
| InChIKey | HDMHBHNRWDNNCD-UHFFFAOYSA-N |
Chemical Property Profile of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine
Property Insights of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine. Following Lipinski's Rule of Five, 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine?
The CAS number of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine is 123027-56-5.
What is the molecular formula of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine?
The molecular formula of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine is C14H16N2O4S.
What is the molecular weight of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine?
The molecular weight of 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine is 308.08307 g/mol.
Where can I buy 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine?
You can request a quote for 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine?
Yes, CoreyChem provides custom synthesis services for 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.