TL;DR: 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl- (CAS 100551-96-0) is a chemical compound with molecular formula C11H8N4 and molecular weight 196.07489 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
7-phenyl-[1,2,4]triazolo[4,3-b]pyridazine
Also Known As: SR 95194, 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl-, 7-Phenyl-1,2,4-triazolo(4,3-b)pyridazine, 7-phenyl-[1,2,4]triazolo[4,3-b]pyridazine, 7-Phenyl[1,2,4]triazolo[4,3-b]pyridazine
| Molecular Formula | C11H8N4 |
| Molecular Weight | 196.07489 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 196.07489 Da |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
| SMILES | C1=CC=C(C=C1)C2=CC3=NN=CN3N=C2 |
| InChIKey | LNNFYJVOFFKGRE-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl-. With a topological polar surface area (TPSA) of 43.1 Ų, 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl- is 100551-96-0.
The molecular formula of 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl- is C11H8N4.
The molecular weight of 1,2,4-Triazolo(4,3-b)pyridazine, 7-phenyl- is 196.07489 g/mol.
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