TL;DR: 5-(2-bromophenyl)-1H-pyrazol-3-amine (CAS 1031793-63-1) is a chemical compound with molecular formula C9H8BrN3 and molecular weight 236.99016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2-bromophenyl)-1H-pyrazol-3-amine
Also Known As: 5-(2-bromophenyl)-1H-pyrazol-3-amine, 3-Amino-5-(2-bromophenyl)-1H-pyrazole, 5-amino-3-(o-bromophenyl)pyrazole, 1H-Pyrazol-3-amine,5-(2-bromophenyl)-, 5-amino-3-(2-bromophenyl)pyrazole
| Molecular Formula | C9H8BrN3 |
| Molecular Weight | 236.99016 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 54.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.99016 Da |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
| SMILES | C1=CC=C(C(=C1)C2=CC(=NN2)N)Br |
| InChIKey | XXYPTBHOALDDSN-UHFFFAOYSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-bromophenyl)-1H-pyrazol-3-amine. With a topological polar surface area (TPSA) of 54.7 Ų, 5-(2-bromophenyl)-1H-pyrazol-3-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-bromophenyl)-1H-pyrazol-3-amine has 2 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 5-(2-bromophenyl)-1H-pyrazol-3-amine is 1031793-63-1.
The molecular formula of 5-(2-bromophenyl)-1H-pyrazol-3-amine is C9H8BrN3.
The molecular weight of 5-(2-bromophenyl)-1H-pyrazol-3-amine is 236.99016 g/mol.
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