TL;DR: 8,5'-Cyclo-2'-deoxyadenosine (CAS 1171829-49-4) is a chemical compound with molecular formula C10H11N5O3 and molecular weight 249.08618 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,11S,12S,13S)-7-amino-15-oxa-2,4,6,9-tetrazatetracyclo[10.2.1.02,10.03,8]pentadeca-3,5,7,9-tetraene-11,13-diol
Also Known As: 8,5'-Cda, 2'-Deoxy-8,5'-cycloadenosine, 8,5'-Cyclo-2'-deoxyadenosine, 5',8-cyclo-2'-deoxyadenosine, 2,3-Naphthalenedicarboxylic acid
| Molecular Formula | C10H11N5O3 |
| Molecular Weight | 249.08618 g/mol |
| XLogP | -1.8 |
| Topological Polar Surface Area (TPSA) | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 249.08618 Da |
| Heavy Atoms | 18 |
| Complexity | 358.0 |
| SMILES | C1[C@@H]([C@H]2[C@H](C3=NC4=C(N=CN=C4N3[C@@H]1O2)N)O)O |
| InChIKey | MBVGIEDXZGVICG-HPQVQDLLSA-N |
The XLogP value of -1.8 indicates that 8,5'-Cyclo-2'-deoxyadenosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8,5'-Cyclo-2'-deoxyadenosine. Following Lipinski's Rule of Five, 8,5'-Cyclo-2'-deoxyadenosine 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 8,5'-Cyclo-2'-deoxyadenosine is 1171829-49-4.
The molecular formula of 8,5'-Cyclo-2'-deoxyadenosine is C10H11N5O3.
The molecular weight of 8,5'-Cyclo-2'-deoxyadenosine is 249.08618 g/mol.
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