1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine
TL;DR: 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine (CAS 1431963-09-5) is a chemical compound with molecular formula C12H14BrN3 and molecular weight 279.0371 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-amine
Also Known As: 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine, 1-[(4-bromophenyl)methyl]-3,5-dimethyl-1h-pyrazol-4-amine, 1-(4-Bromo-benzyl)-3,5-dimethyl-1H-pyrazol-4-ylamine, 1-[(4-bromophenyl)methyl]-3,5-dimethylpyrazol-4-amine, 1H-Pyrazole, 4-amino-1-(4-bromobenzyl)-3,5-dimethyl-
Technical Specifications
| Molecular Formula | C12H14BrN3 |
| Molecular Weight | 279.0371 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 279.0371 Da |
| Heavy Atoms | 16 |
| Complexity | 228.0 |
| SMILES | CC1=C(C(=NN1CC2=CC=C(C=C2)Br)C)N |
| InChIKey | ISCVDXHEVQURAS-UHFFFAOYSA-N |
Chemical Property Profile of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine
Property Insights of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine. With a topological polar surface area (TPSA) of 43.8 Ų, 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-bromobenzyl)-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.
Frequently Asked Questions
What is the CAS number of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine?
The CAS number of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine is 1431963-09-5.
What is the molecular formula of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine?
The molecular formula of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine is C12H14BrN3.
What is the molecular weight of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine?
The molecular weight of 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine is 279.0371 g/mol.
Where can I buy 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine?
You can request a quote for 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine?
Yes, CoreyChem provides custom synthesis services for 1-(4-bromobenzyl)-3,5-dimethyl-1H-pyrazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.