5'-Adenylic acid, N-benzyl-, diammonium salt
TL;DR: 5'-Adenylic acid, N-benzyl-, diammonium salt (CAS 102366-80-3) is a chemical compound with molecular formula C17H26N7O7P and molecular weight 471.16315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azane;[(2R,3S,4R,5R)-5-[6-(benzylamino)purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: N(sup 6)Bar5P, 5'-ADENYLIC ACID, N-BENZYL-, DIAMMONIUM SALT, N(sup 6)Benzyladenosine-5'-monophosphate diammonium salt, Adenosine, N-benzyl-, 5'-monophosphate, diammonium salt, n-benzyladenosine 5'-(dihydrogen phosphate) diammoniate
Technical Specifications
| Molecular Formula | C17H26N7O7P |
| Molecular Weight | 471.16315 g/mol |
| XLogP | 0.49 |
| Topological Polar Surface Area (TPSA) | 174.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 471.16315 Da |
| Heavy Atoms | 32 |
| Complexity | 621.0 |
| SMILES | C1=CC=C(C=C1)CNC2=C3C(=NC=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)(O)O)O)O.N.N |
| InChIKey | NMJDWJAJQXXTPT-CXKSGAPPSA-N |
Chemical Property Profile of 5'-Adenylic acid, N-benzyl-, diammonium salt
Property Insights of 5'-Adenylic acid, N-benzyl-, diammonium salt
The XLogP value of 0.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-Adenylic acid, N-benzyl-, diammonium salt. The TPSA of 174.0 Ų indicates high polarity, suggesting 5'-Adenylic acid, N-benzyl-, diammonium salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'-Adenylic acid, N-benzyl-, diammonium salt has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5'-Adenylic acid, N-benzyl-, diammonium salt?
The CAS number of 5'-Adenylic acid, N-benzyl-, diammonium salt is 102366-80-3.
What is the molecular formula of 5'-Adenylic acid, N-benzyl-, diammonium salt?
The molecular formula of 5'-Adenylic acid, N-benzyl-, diammonium salt is C17H26N7O7P.
What is the molecular weight of 5'-Adenylic acid, N-benzyl-, diammonium salt?
The molecular weight of 5'-Adenylic acid, N-benzyl-, diammonium salt is 471.16315 g/mol.
Where can I buy 5'-Adenylic acid, N-benzyl-, diammonium salt?
You can request a quote for 5'-Adenylic acid, N-benzyl-, diammonium salt directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5'-Adenylic acid, N-benzyl-, diammonium salt?
Yes, CoreyChem provides custom synthesis services for 5'-Adenylic acid, N-benzyl-, diammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.