TL;DR: 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide (CAS 1005640-34-5) is a chemical compound with molecular formula C14H12BrClN4O and molecular weight 365.9883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide
Also Known As: 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide, 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyano-phenyl)-2-methyl-propanamide, 3-(4-bromo-1H-pyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide, 3-(4-BROMO-1H-PYRAZOL-1-YL)-N~1~-(5-CHLORO-2-CYANOPHENYL)-2-METHYLPROPANAMIDE
| Molecular Formula | C14H12BrClN4O |
| Molecular Weight | 365.9883 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 70.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.9883 Da |
| Heavy Atoms | 21 |
| Complexity | 426.0 |
| SMILES | CC(CN1C=C(C=N1)Br)C(=O)NC2=C(C=CC(=C2)Cl)C#N |
| InChIKey | GVTIRHAHGBOTEV-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide. Following Lipinski's Rule of Five, 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-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-(5-chloro-2-cyanophenyl)-2-methylpropanamide is 1005640-34-5.
The molecular formula of 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide is C14H12BrClN4O.
The molecular weight of 3-(4-bromopyrazol-1-yl)-N-(5-chloro-2-cyanophenyl)-2-methylpropanamide is 365.9883 g/mol.
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