TL;DR: N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide (CAS 1005608-49-0) is a chemical compound with molecular formula C17H24BrN3O and molecular weight 365.11026 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide
Also Known As: N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide, adamantanyl-N-[3-(4-bromopyrazolyl)propyl]carboxamide, N-[3-(4-BROMO-1H-PYRAZOL-1-YL)PROPYL]-1-ADAMANTANECARBOXAMIDE, N-[3-(4-bromo-1H-pyrazol-1-yl)propyl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
| Molecular Formula | C17H24BrN3O |
| Molecular Weight | 365.11026 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 365.11026 Da |
| Heavy Atoms | 22 |
| Complexity | 400.0 |
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NCCCN4C=C(C=N4)Br |
| InChIKey | XTJNHPZHCHRAJZ-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide 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-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide 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-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide is 1005608-49-0.
The molecular formula of N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide is C17H24BrN3O.
The molecular weight of N-[3-(4-bromopyrazol-1-yl)propyl]adamantane-1-carboxamide is 365.11026 g/mol.
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