HEPT-U
TL;DR: HEPT-U (CAS 125057-06-9) is a chemical compound with molecular formula C13H14N2O3S2 and molecular weight 310.0446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-hydroxyethoxymethyl)-6-phenylsulfanyl-2-sulfanylidenepyrimidin-4-one
Also Known As: HEPT-U, 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)-2-thiouracil, 4(1H)-Pyrimidinone, 2,3-dihydro-1-((2-hydroxyethoxy)methyl)-6-(phenylthio)-2-thioxo-, 1-[(2-Hydroxyethoxy)methyl]-6-(phenylthio)-2-thiouracil, 1-(2-hydroxyethoxymethyl)-6-phenylsulfanyl-2-sulfanylidenepyrimidin-4-one
Technical Specifications
| Molecular Formula | C13H14N2O3S2 |
| Molecular Weight | 310.0446 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 310.0446 Da |
| Heavy Atoms | 20 |
| Complexity | 395.0 |
| SMILES | C1=CC=C(C=C1)SC2=CC(=O)NC(=S)N2COCCO |
| InChIKey | JKGGSNAHULFEHC-UHFFFAOYSA-N |
Chemical Property Profile of HEPT-U
Property Insights of HEPT-U
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for HEPT-U. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for HEPT-U. Following Lipinski's Rule of Five, HEPT-U 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 HEPT-U?
The CAS number of HEPT-U is 125057-06-9.
What is the molecular formula of HEPT-U?
The molecular formula of HEPT-U is C13H14N2O3S2.
What is the molecular weight of HEPT-U?
The molecular weight of HEPT-U is 310.0446 g/mol.
Where can I buy HEPT-U?
You can request a quote for HEPT-U directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for HEPT-U?
Yes, CoreyChem provides custom synthesis services for HEPT-U and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.