TL;DR: Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- (CAS 117456-69-6) is a chemical compound with molecular formula C28H27N5O6 and molecular weight 529.1961 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,2R,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol
Also Known As: Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))-, (1R,2R,3R,4S)-1-[[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-6-yl]amino]-1,2,3,4-tetrahydrobenzo[g]phenanthrene-2,3,4-triol, 2'-deoxy-n-[(1r,2r,3r,4s)-2,3,4-trihydroxy-1,2,3,4-tetrahydrobenzo[c]phenanthren-1-yl]adenosine, Adenosine, 2'-deoxy-N-((1R,2R,3R,4S)-1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, Adenosine, 2'-deoxy-N-((1R,2S,3R,4S)-1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-
| Molecular Formula | C28H27N5O6 |
| Molecular Weight | 529.1961 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 166.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 529.1961 Da |
| Heavy Atoms | 39 |
| Complexity | 872.0 |
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N[C@H]4[C@H]([C@@H]([C@H](C5=C4C6=C(C=CC7=CC=CC=C76)C=C5)O)O)O)CO)O |
| InChIKey | KZCQTFDJSLTNCI-FRPZRZOGSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))-. The TPSA of 166.0 Ų indicates high polarity, suggesting Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- is 117456-69-6.
The molecular formula of Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- is C28H27N5O6.
The molecular weight of Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- is 529.1961 g/mol.
You can request a quote for Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1R-(1alpha,2alpha,3beta,4alpha))- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 117456-69-6. Our professional technical team will respond with pricing and lead time.