TpTp
TL;DR: TpTp (CAS 1144515-97-8) is a chemical compound with molecular formula C20H28N4O15P2 and molecular weight 626.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,5S)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] [(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate
Also Known As: TpTp, d(Ptpt), KST-1A3495, Thymidylyl-(3'-5')-3'-thymidylic acid, 2,6,14-tris(diphenylamino)triptycene
| Molecular Formula | C20H28N4O15P2 |
|---|---|
| Molecular Weight | 626.10 g/mol |
| LogP | -4.2 |
| Topological Polar Surface Area | 260.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 626.10266 |
| Heavy Atoms | 41 |
| Complexity | 1270.0 |
Chemical Identifiers
| CAS Number | 1144515-97-8 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@@H]2C[C@@H]([C@H](O2)CO)OP(=O)(O)OC[C@@H]3[C@H](C[C@@H](O3)N4C=C(C(=O)NC4=O)C)OP(=O)(O)O |
| InChIKey | LPGUBBCKPSUVTG-UGYDUONOSA-N |
Product Overview
TpTp (CAS 1144515-97-8), with molecular formula C20H28N4O15P2 and molecular weight 626.10 g/mol. IUPAC: [(2R,3S,5S)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-3-yl] [(2R,3S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)-3-phosphonooxyoxolan-2-yl]methyl hydrogen phosphate.
Chemical Property Profile of TpTp
Property Insights of TpTp
The XLogP value of -4.2 indicates that TpTp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 260.0 Ų indicates high polarity, suggesting TpTp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, TpTp has 6 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of TpTp?
The CAS number of TpTp is 1144515-97-8.
What is the molecular formula of TpTp?
The molecular formula of TpTp is C20H28N4O15P2.
What is the molecular weight of TpTp?
The molecular weight of TpTp is 626.10 g/mol.
Where can I buy TpTp?
You can request a quote for TpTp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TpTp?
Yes, KEHONG BIO provides custom synthesis services for TpTp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.