TL;DR: 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole (CAS 1005613-35-3) is a chemical compound with molecular formula C6H7N7O2 and molecular weight 209.06612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[2-(4-nitropyrazol-1-yl)ethyl]-2H-tetrazole
Also Known As: 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole, 5-[2-(4-nitropyrazol-1-yl)ethyl]-2H-tetrazole, 5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-2H-1,2,3,4-tetrazole, 5-(2-(4-Nitro-1h-pyrazol-1-yl)ethyl)-2h-tetrazole, 5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-2H-tetrazole
| Molecular Formula | C6H7N7O2 |
| Molecular Weight | 209.06612 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.06612 Da |
| Heavy Atoms | 15 |
| Complexity | 232.0 |
| SMILES | C1=C(C=NN1CCC2=NNN=N2)[N+](=O)[O-] |
| InChIKey | DGBDNYFQRIJAJQ-UHFFFAOYSA-N |
The XLogP value of -0.5 indicates that 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole. Following Lipinski's Rule of Five, 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole is 1005613-35-3.
The molecular formula of 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole is C6H7N7O2.
The molecular weight of 5-[2-(4-Nitro-pyrazol-1-yl)-ethyl]-2H-tetrazole is 209.06612 g/mol.
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