TL;DR: N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide (CAS 714942-18-4) is a chemical compound with molecular formula C20H18N4O and molecular weight 330.14807 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide
Also Known As: N-(1,8-dimethyl-1H-pyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide, N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide, N-[(3Z)-1,8-dimethyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]-4-methylbenzamide
| Molecular Formula | C20H18N4O |
| Molecular Weight | 330.14807 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 59.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.14807 Da |
| Heavy Atoms | 25 |
| Complexity | 490.0 |
| SMILES | CC1=CC=C(C=C1)C(=O)NC2=NN(C3=NC4=C(C=CC=C4C=C23)C)C |
| InChIKey | BCGHITQILHMZLJ-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide has 1 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 N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide is 714942-18-4.
The molecular formula of N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide is C20H18N4O.
The molecular weight of N-(1,8-dimethylpyrazolo[3,4-b]quinolin-3-yl)-4-methylbenzamide is 330.14807 g/mol.
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