![1S(-)-trans-anti-[BPh]-N6-dA structure](/static/products/1070/107033-13-6.webp)
1S(-)-trans-anti-[BPh]-N6-dA
TL;DR: 1S(-)-trans-anti-[BPh]-N6-dA (CAS 107033-13-6) 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.
(1S,2R,3S,4R)-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: 1S(-)-trans-anti-[BPh]-N6-dA, J1.459.145A, 1S(-)-trans-anti-Benzo[c]phenanthrene-N6-deoxyadenosine, Adenosine, 2'-deoxy-N-((1S,2R,3S,4R)-1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, Adenosine, 2'-deoxy-N-(1,2,3,4-tetrahydro-2,3,4-trihydroxybenzo(c)phenanthren-1-yl)-, (1S-(1alpha,2beta,3beta,4alpha))-
Technical Specifications
| 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-VJXGRACFSA-N |
Chemical Property Profile of 1S(-)-trans-anti-[BPh]-N6-dA
Property Insights of 1S(-)-trans-anti-[BPh]-N6-dA
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1S(-)-trans-anti-[BPh]-N6-dA. The TPSA of 166.0 Ų indicates high polarity, suggesting 1S(-)-trans-anti-[BPh]-N6-dA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1S(-)-trans-anti-[BPh]-N6-dA has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1S(-)-trans-anti-[BPh]-N6-dA?
The CAS number of 1S(-)-trans-anti-[BPh]-N6-dA is 107033-13-6.
What is the molecular formula of 1S(-)-trans-anti-[BPh]-N6-dA?
The molecular formula of 1S(-)-trans-anti-[BPh]-N6-dA is C28H27N5O6.
What is the molecular weight of 1S(-)-trans-anti-[BPh]-N6-dA?
The molecular weight of 1S(-)-trans-anti-[BPh]-N6-dA is 529.1961 g/mol.
Where can I buy 1S(-)-trans-anti-[BPh]-N6-dA?
You can request a quote for 1S(-)-trans-anti-[BPh]-N6-dA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1S(-)-trans-anti-[BPh]-N6-dA?
Yes, CoreyChem provides custom synthesis services for 1S(-)-trans-anti-[BPh]-N6-dA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.