TL;DR: 6-(piperazin-1-yl)-9H-purine (CAS 1179486-17-9) is a chemical compound with molecular formula C9H12N6 and molecular weight 204.11235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-piperazin-1-yl-7H-purine
Also Known As: 6-(piperazin-1-yl)-9H-purine, 6-piperazin-1-yl-9H-purine, 6-piperazin-1-yl-7H-purine, 6-(1-Piperazinyl)purine, 6-(1-piperazinyl)-9H-purine
| Molecular Formula | C9H12N6 |
| Molecular Weight | 204.11235 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 69.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 204.11235 Da |
| Heavy Atoms | 15 |
| Complexity | 217.0 |
| SMILES | C1CN(CCN1)C2=NC=NC3=C2NC=N3 |
| InChIKey | FFNVVVLETZYYJN-UHFFFAOYSA-N |
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(piperazin-1-yl)-9H-purine. The TPSA of 69.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(piperazin-1-yl)-9H-purine. Following Lipinski's Rule of Five, 6-(piperazin-1-yl)-9H-purine has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 6-(piperazin-1-yl)-9H-purine is 1179486-17-9.
The molecular formula of 6-(piperazin-1-yl)-9H-purine is C9H12N6.
The molecular weight of 6-(piperazin-1-yl)-9H-purine is 204.11235 g/mol.
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