TL;DR: N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine (CAS 103984-27-6) 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.
N-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine
Also Known As: N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine, AMS_CNC_ID-343634307, N-methyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-amine, methyl-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-amine, G37572
| Molecular Formula | C12H11N5 |
| Molecular Weight | 225.10144 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 55.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.10144 Da |
| Heavy Atoms | 17 |
| Complexity | 253.0 |
| SMILES | CNC1=C2C=NN(C2=NC=N1)C3=CC=CC=C3 |
| InChIKey | ZRRSRZDWRAGYSZ-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine. With a topological polar surface area (TPSA) of 55.6 Ų, N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-1-phenyl-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 N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 103984-27-6.
The molecular formula of N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine is C12H11N5.
The molecular weight of N-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine is 225.10144 g/mol.
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