HEPT-TP
TL;DR: HEPT-TP (CAS 125400-24-0) is a chemical compound with molecular formula C14H19N2O13P3S and molecular weight 547.98206 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[hydroxy-[2-[(5-methyl-2,4-dioxo-6-phenylsulfanylpyrimidin-1-yl)methoxy]ethoxy]phosphoryl] phosphono hydrogen phosphate
Also Known As: HEPT-TP, HEPT deriv., 1-((2-Hydroxyethoxy)methyl)-6-(phenylthio)thymine-triphosphate, Triphosphoric acid, P-(2-((3,4-dihydro-5-methyl-2,4-dioxo-6-(phenylthio)-1(2H)-pyrimidinyl)methoxy)ethyl) ester, 1-[(2-Hydroxyethoxy)methyl]-6-(phenylthio)thymine-triphosphate
Technical Specifications
| Molecular Formula | C14H19N2O13P3S |
| Molecular Weight | 547.98206 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 244.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 12 |
| Exact Mass | 547.98206 Da |
| Heavy Atoms | 33 |
| Complexity | 916.0 |
| SMILES | CC1=C(N(C(=O)NC1=O)COCCOP(=O)(O)OP(=O)(O)OP(=O)(O)O)SC2=CC=CC=C2 |
| InChIKey | JRYKCAQHVWMLLS-UHFFFAOYSA-N |
Chemical Property Profile of HEPT-TP
Property Insights of HEPT-TP
The XLogP value of -2.2 indicates that HEPT-TP is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 244.0 Ų indicates high polarity, suggesting HEPT-TP may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, HEPT-TP has 5 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of HEPT-TP?
The CAS number of HEPT-TP is 125400-24-0.
What is the molecular formula of HEPT-TP?
The molecular formula of HEPT-TP is C14H19N2O13P3S.
What is the molecular weight of HEPT-TP?
The molecular weight of HEPT-TP is 547.98206 g/mol.
Where can I buy HEPT-TP?
You can request a quote for HEPT-TP directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for HEPT-TP?
Yes, CoreyChem provides custom synthesis services for HEPT-TP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.