TL;DR: 2'-Deoxy-8-ethyladenosine (CAS 132638-54-1) is a chemical compound with molecular formula C12H17N5O3 and molecular weight 279.13315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R,3S,5R)-5-(6-amino-8-ethylpurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
Also Known As: 2'-Deoxy-8-ethyladenosine, 8-Ethyl-2 -deoxyadenosine, (2R,3S,5R)-5-(6-amino-8-ethylpurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol, (2R,3S,5R)-5-(6-amino-8-ethyl-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol, (2R,3S,5R)-5-(6-amino-8-ethyl-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-ol
| Molecular Formula | C12H17N5O3 |
| Molecular Weight | 279.13315 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 279.13315 Da |
| Heavy Atoms | 20 |
| Complexity | 347.0 |
| SMILES | CCC1=NC2=C(N=CN=C2N1[C@H]3C[C@@H]([C@H](O3)CO)O)N |
| InChIKey | ZBCNEVDSHOHZCZ-LKEWCRSYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Deoxy-8-ethyladenosine. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2'-Deoxy-8-ethyladenosine. Following Lipinski's Rule of Five, 2'-Deoxy-8-ethyladenosine has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2'-Deoxy-8-ethyladenosine is 132638-54-1.
The molecular formula of 2'-Deoxy-8-ethyladenosine is C12H17N5O3.
The molecular weight of 2'-Deoxy-8-ethyladenosine is 279.13315 g/mol.
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