TL;DR: 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide (CAS 1005660-53-6) is a chemical compound with molecular formula C13H15Br2N3O2 and molecular weight 402.9531 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide
Also Known As: 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide, 5-BROMO-N-[3-(4-BROMO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)PROPYL]-2-FURAMIDE, 5-bromo-N-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propyl]furan-2-carboxamide, 5-bromo-N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]furan-2-carboxamide
| Molecular Formula | C13H15Br2N3O2 |
| Molecular Weight | 402.9531 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 60.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.9531 Da |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
| SMILES | CC1=C(C(=NN1CCCNC(=O)C2=CC=C(O2)Br)C)Br |
| InChIKey | QNPIPFDSZVBDOO-UHFFFAOYSA-N |
The XLogP value of 3.4 indicates that 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide. Following Lipinski's Rule of Five, 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide 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 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide is 1005660-53-6.
The molecular formula of 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide is C13H15Br2N3O2.
The molecular weight of 5-bromo-N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]furan-2-carboxamide is 402.9531 g/mol.
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