TL;DR: 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 103984-26-5) is a chemical compound with molecular formula C12H11N5 and molecular weight 225.10144 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
Also Known As: 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine, 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamine, 1-(4-methylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine, 1-(p-tolyl)pyrazolo[3,4-d]pyrimidin-4-amine, 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamin
| Molecular Formula | C12H11N5 |
| Molecular Weight | 225.10144 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 225.10144 Da |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
| SMILES | CC1=CC=C(C=C1)N2C3=NC=NC(=C3C=N2)N |
| InChIKey | HMFJTCIVXMZQIC-UHFFFAOYSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine. Following Lipinski's Rule of Five, 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine 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 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 103984-26-5.
The molecular formula of 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine is C12H11N5.
The molecular weight of 1-p-Tolyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 225.10144 g/mol.
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