TL;DR: N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide (CAS 1005643-20-8) is a chemical compound with molecular formula C14H14BrCl2N3O and molecular weight 388.96973 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide
Also Known As: N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide, N-[3-(4-bromo-3-methyl-1H-pyrazol-1-yl)propyl]-2,4-dichlorobenzamide, N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-2,4-dichloro-benzamide
| Molecular Formula | C14H14BrCl2N3O |
| Molecular Weight | 388.96973 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.96973 Da |
| Heavy Atoms | 21 |
| Complexity | 361.0 |
| SMILES | CC1=NN(C=C1Br)CCCNC(=O)C2=C(C=C(C=C2)Cl)Cl |
| InChIKey | WAOZJWLNYZRJIV-UHFFFAOYSA-N |
The XLogP value of 3.8 indicates that N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.9 Ų, N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide is 1005643-20-8.
The molecular formula of N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide is C14H14BrCl2N3O.
The molecular weight of N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-2,4-dichlorobenzamide is 388.96973 g/mol.
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