TL;DR: 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid (CAS 1071547-50-6) is a chemical compound with molecular formula C11H13N3O2 and molecular weight 219.10077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylic acid
Also Known As: 1-Isopropyl-6-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid, RETENE, 1704AF, 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid, ASN 16358852
| Molecular Formula | C11H13N3O2 |
| Molecular Weight | 219.10077 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 68.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.10077 Da |
| Heavy Atoms | 16 |
| Complexity | 282.0 |
| SMILES | CC1=CC(=C2C=NN(C2=N1)C(C)C)C(=O)O |
| InChIKey | FZTBEHSMFGKXNA-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid. The TPSA of 68.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid. Following Lipinski's Rule of Five, 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid 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 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid is 1071547-50-6.
The molecular formula of 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid is C11H13N3O2.
The molecular weight of 6-methyl-1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid is 219.10077 g/mol.
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