TL;DR: 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide (CAS 1005617-59-3) is a chemical compound with molecular formula C15H18BrN3O2 and molecular weight 351.05823 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide
Also Known As: 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide, 3-(4-bromo-1H-pyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide, 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methyl-phenyl)-2-methyl-propanamide
| Molecular Formula | C15H18BrN3O2 |
| Molecular Weight | 351.05823 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 56.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.05823 Da |
| Heavy Atoms | 21 |
| Complexity | 356.0 |
| SMILES | CC1=CC(=C(C=C1)OC)NC(=O)C(C)CN2C=C(C=N2)Br |
| InChIKey | CCXZYNHBPDSDBT-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide. With a topological polar surface area (TPSA) of 56.2 Ų, 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide 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 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide is 1005617-59-3.
The molecular formula of 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide is C15H18BrN3O2.
The molecular weight of 3-(4-bromopyrazol-1-yl)-N-(2-methoxy-5-methylphenyl)-2-methylpropanamide is 351.05823 g/mol.
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