TL;DR: 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine (CAS 1431965-46-6) is a chemical compound with molecular formula C5H8BrN3 and molecular weight 188.99016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-bromo-1,3-dimethylpyrazol-5-amine
Also Known As: 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine, 4-bromo-2,5-dimethylpyrazol-3-amine, 4-Bromo-2,5-dimethyl-2H-pyrazol-3-ylamine, 1H-Pyrazol-5-amine, 4-bromo-1,3-dimethyl-, Pyrazol-5-amine, 4-bromo-1,3-dimethyl-
| Molecular Formula | C5H8BrN3 |
| Molecular Weight | 188.99016 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 188.99016 Da |
| Heavy Atoms | 9 |
| Complexity | 108.0 |
| SMILES | CC1=NN(C(=C1Br)N)C |
| InChIKey | XZVCZZLJWIYRMT-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine. With a topological polar surface area (TPSA) of 43.8 Ų, 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine 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 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine is 1431965-46-6.
The molecular formula of 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine is C5H8BrN3.
The molecular weight of 4-Bromo-1,3-dimethyl-1H-pyrazol-5-amine is 188.99016 g/mol.
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