Amptep
TL;DR: Amptep (CAS 125162-97-2) is a chemical compound with molecular formula C22H31N7O6S and molecular weight 521.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Amptep
(2R,3R,4S,5R)-2-[6-[3-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylamino]propylsulfanylmethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: Amptep, Adenosine-N(6)-methyl-propylthioether-N-pyridoxamine, SID:134223158, (2R,3R,4S,5R)-2-[6-[3-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylamino]propylsulfanylmethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, Adenosine, N-(((3-(((3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl)methyl)amino)propyl)thio)methyl)-
| Molecular Formula | C22H31N7O6S |
|---|---|
| Molecular Weight | 521.21 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 12 |
| Exact Mass | 521.2056 |
| Heavy Atoms | 36 |
| Complexity | 674.0 |
Chemical Identifiers
| CAS Number | 125162-97-2 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)CNCCCSCNC2=C3C(=NC=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)CO |
| InChIKey | XLRAIUMUVOXBBC-CIVUBGFFSA-N |
Product Overview
Amptep (CAS 125162-97-2), with molecular formula C22H31N7O6S and molecular weight 521.21 g/mol. IUPAC: (2R,3R,4S,5R)-2-[6-[3-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methylamino]propylsulfanylmethylamino]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of Amptep
Property Insights of Amptep
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Amptep. The TPSA of 216.0 Ų indicates high polarity, suggesting Amptep may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Amptep has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Amptep?
The CAS number of Amptep is 125162-97-2.
What is the molecular formula of Amptep?
The molecular formula of Amptep is C22H31N7O6S.
What is the molecular weight of Amptep?
The molecular weight of Amptep is 521.21 g/mol.
Where can I buy Amptep?
You can request a quote for Amptep directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Amptep?
Yes, KEHONG BIO provides custom synthesis services for Amptep and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.