Adtepp
TL;DR: Adtepp (CAS 120151-99-7) is a chemical compound with molecular formula C22H30N7O9PS and molecular weight 599.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Adtepp
[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
| Molecular Formula | C22H30N7O9PS |
|---|---|
| Molecular Weight | 599.16 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 263.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 13 |
| Exact Mass | 599.1563 |
| Heavy Atoms | 40 |
| Complexity | 878.0 |
Chemical Identifiers
| CAS Number | 120151-99-7 |
|---|---|
| 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 |
Product Overview
Adtepp (CAS 120151-99-7), with molecular formula C22H30N7O9PS and molecular weight 599.16 g/mol. IUPAC: [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.
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
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 599.16 g/mol.
Where can I buy Adtepp?
You can request a quote for Adtepp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adtepp?
Yes, KEHONG BIO provides custom synthesis services for Adtepp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.