1-Cyclopropylisoguanosine
TL;DR: 1-Cyclopropylisoguanosine (CAS 133967-00-7) is a chemical compound with molecular formula C13H17N5O5 and molecular weight 323.12296 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-1-cyclopropyl-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-2-one
Also Known As: 1-Cyclopropylisoguanosine, BN 063, 1-Cyclopropyl-2-oxo-2-hydroadenosine, 1-Cyclopropyl-1,2-dihydro-2-oxoadenosine, Adenosine, 1-cyclopropyl-1,2-dihydro-2-oxo-
Technical Specifications
| Molecular Formula | C13H17N5O5 |
| Molecular Weight | 323.12296 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 144.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.12296 Da |
| Heavy Atoms | 23 |
| Complexity | 643.0 |
| SMILES | C1CC1N2C(=C3C(=NC2=O)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
| InChIKey | WHBIVTCTMMRQMU-WOUKDFQISA-N |
Chemical Property Profile of 1-Cyclopropylisoguanosine
Property Insights of 1-Cyclopropylisoguanosine
The XLogP value of -2.2 indicates that 1-Cyclopropylisoguanosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 144.0 Ų indicates high polarity, suggesting 1-Cyclopropylisoguanosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Cyclopropylisoguanosine has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Cyclopropylisoguanosine?
The CAS number of 1-Cyclopropylisoguanosine is 133967-00-7.
What is the molecular formula of 1-Cyclopropylisoguanosine?
The molecular formula of 1-Cyclopropylisoguanosine is C13H17N5O5.
What is the molecular weight of 1-Cyclopropylisoguanosine?
The molecular weight of 1-Cyclopropylisoguanosine is 323.12296 g/mol.
Where can I buy 1-Cyclopropylisoguanosine?
You can request a quote for 1-Cyclopropylisoguanosine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Cyclopropylisoguanosine?
Yes, CoreyChem provides custom synthesis services for 1-Cyclopropylisoguanosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.