Adtepp
TL;DR: Adtepp (CAS 120151-99-7) is a chemical compound with molecular formula C22H30N7O9PS and molecular weight 599.1563 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[2-[2-[[9-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]ethylsulfanyl]ethyliminomethyl]-5-hydroxy-6-methyl-3-pyridinyl]methyl dihydrogen phosphate
Also Known As: Adtepp, Adenosine-N(6)-diethylthioether-N'-pyridoximine 5'-phosphate, [4-[2-[2-[[9-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]ethylsulfanyl]ethyliminomethyl]-5-hydroxy-6-methylpyridin-3-yl]methyl dihydrogen phosphate, adenosine-N(6)-diethylthioether-N/'-pyridoximine 5/'-phosphate, [(4Z)-4-[[2-[2-[[9-[(3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]ethylsulfanyl]ethylamino]methylidene]-6-methyl-5-oxopyridin-3-yl]methyl dihydrogen phosphate
Technical Specifications
| Molecular Formula | C22H30N7O9PS |
| Molecular Weight | 599.1563 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 263.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 13 |
| Exact Mass | 599.1563 Da |
| Heavy Atoms | 40 |
| Complexity | 878.0 |
| SMILES | CC1=NC=C(C(=C1O)C=NCCSCCNC2=C3C(=NC=N2)N(C=N3)C4[C@@H]([C@@H]([C@H](O4)CO)O)O)COP(=O)(O)O |
| InChIKey | UNZWIPPZCSNPQR-CRWZYULMSA-N |
Chemical Property Profile of Adtepp
Property Insights of Adtepp
The XLogP value of -1.5 indicates that Adtepp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 263.0 Ų indicates high polarity, suggesting Adtepp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adtepp has 7 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Adtepp?
The CAS number of Adtepp is 120151-99-7.
What is the molecular formula of Adtepp?
The molecular formula of Adtepp is C22H30N7O9PS.
What is the molecular weight of Adtepp?
The molecular weight of Adtepp is 599.1563 g/mol.
Where can I buy Adtepp?
You can request a quote for Adtepp directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Adtepp?
Yes, CoreyChem provides custom synthesis services for Adtepp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.