TL;DR: 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine (CAS 153562-20-0) is a chemical compound with molecular formula C11H6F3N5 and molecular weight 265.05753 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-phenyl-5-(trifluoromethyl)tetrazolo[1,5-a]pyrimidine
Also Known As: 7-phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine, 7-phenyl-5-(trifluoromethyl)tetrazolo[1,5-a]pyrimidine, 7-phenyl-5-(trifluoromethyl)-[1,2,3,4]tetrazolo[1,5-a]pyrimidine, 1W-0913, C11H6F3N5
| Molecular Formula | C11H6F3N5 |
| Molecular Weight | 265.05753 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 56.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 265.05753 Da |
| Heavy Atoms | 19 |
| Complexity | 318.0 |
| SMILES | C1=CC=C(C=C1)C2=CC(=NC3=NN=NN23)C(F)(F)F |
| InChIKey | DWMLOVORRHEENE-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine. With a topological polar surface area (TPSA) of 56.0 Ų, 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine is 153562-20-0.
The molecular formula of 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine is C11H6F3N5.
The molecular weight of 7-Phenyl-5-(trifluoromethyl)[1,2,3,4]tetraazolo[1,5-a]pyrimidine is 265.05753 g/mol.
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