TL;DR: 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine (CAS 1147211-12-8) is a chemical compound with molecular formula C12H13Cl2N3 and molecular weight 269.04865 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-amine
Also Known As: 1-(2,4-Dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine, 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethyl-1h-pyrazol-4-amine, 1-[(2,4-dichlorophenyl)methyl]-3,5-dimethylpyrazol-4-amine, Z-0607, 1-(2,4-Dichloro-benzyl)-3,5-dimethyl-1H-pyrazol-4-ylamine
| Molecular Formula | C12H13Cl2N3 |
| Molecular Weight | 269.04865 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 269.04865 Da |
| Heavy Atoms | 17 |
| Complexity | 264.0 |
| SMILES | CC1=C(C(=NN1CC2=C(C=C(C=C2)Cl)Cl)C)N |
| InChIKey | RTOMSIDYLGGAIA-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-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 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine is 1147211-12-8.
The molecular formula of 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine is C12H13Cl2N3.
The molecular weight of 1-((2,4-Dichlorophenyl)methyl)-3,5-dimethyl-1H-pyrazol-4-amine is 269.04865 g/mol.
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