TL;DR: 9H-Purin-6-amine, 9-cyclobutyl- (CAS 132406-73-6) is a chemical compound with molecular formula C9H11N5 and molecular weight 189.10144 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-cyclobutylpurin-6-amine
Also Known As: 9-Cyclobutyladenine, 9-cyclobutylpurin-6-amine, 9-cBuA, 9-Cyclobutyl-9H-purin-6-amine, 9-Cyclobutyl-9H-adenine
| Molecular Formula | C9H11N5 |
| Molecular Weight | 189.10144 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.10144 Da |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
| SMILES | C1CC(C1)N2C=NC3=C(N=CN=C32)N |
| InChIKey | JGFAEEKLMAWINF-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purin-6-amine, 9-cyclobutyl-. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Purin-6-amine, 9-cyclobutyl-. Following Lipinski's Rule of Five, 9H-Purin-6-amine, 9-cyclobutyl- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 9H-Purin-6-amine, 9-cyclobutyl- is 132406-73-6.
The molecular formula of 9H-Purin-6-amine, 9-cyclobutyl- is C9H11N5.
The molecular weight of 9H-Purin-6-amine, 9-cyclobutyl- is 189.10144 g/mol.
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